Phenylpropanoids and polyketides

Phenylpropanoids and polyketides




















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Paraffin, liquid, pure, Thermo Scientific Chemicals
CAS: 8012-95-1 Molecular Formula: MFCD00131611 Molecular Weight (g/mol): 0.00 MDL Number: MFCD00131611 InChI Key: FFNDMZIBVDSQFI-UHFFFAOYSA-N Synonym: delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride PubChem CID: 68245 ChEBI: CHEBI:38701 IUPAC Name: 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride SMILES: *
PubChem CID | 68245 |
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CAS | 8012-95-1 |
Molecular Weight (g/mol) | 0.00 |
ChEBI | CHEBI:38701 |
MDL Number | MFCD00131611 |
SMILES | * |
Synonym | delphinidin chloride,delphinidin,delphinidine,delphinidol,ephdine,delfinidol chloride,unii-em6md4aehe,ccris 2518,em6md4aehe,3,5,7-trihydroxy-2-3,4,5-trihydroxyphenyl benzopyrylium chloride |
IUPAC Name | 2-(3,4,5-trihydroxyphenyl)chromenylium-3,5,7-triol;chloride |
InChI Key | FFNDMZIBVDSQFI-UHFFFAOYSA-N |
Molecular Formula | MFCD00131611 |
4,4'-Diaminostilbene-2,2'-disulfonic Acid 94.0+%, TCI America™
CAS: 81-11-8 Molecular Formula: C14H14N2O6S2 Molecular Weight (g/mol): 370.394 MDL Number: MFCD00024946 InChI Key: REJHVSOVQBJEBF-OWOJBTEDSA-N Synonym: amsonic acid,flavonic acid,tinopal bhs,amsonsaeure,dasd,4,4'-diaminostilbene-2,2'-disulfonic acid,unii-h68088wvjl,2,2'-disulfo-4,4'-stilbenediamine,diaminostilbenedisulfonic acid,4,4'-diaminostilbene-2,2'-disulphonic acid PubChem CID: 5284378 IUPAC Name: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid SMILES: C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O
PubChem CID | 5284378 |
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CAS | 81-11-8 |
Molecular Weight (g/mol) | 370.394 |
MDL Number | MFCD00024946 |
SMILES | C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O |
Synonym | amsonic acid,flavonic acid,tinopal bhs,amsonsaeure,dasd,4,4'-diaminostilbene-2,2'-disulfonic acid,unii-h68088wvjl,2,2'-disulfo-4,4'-stilbenediamine,diaminostilbenedisulfonic acid,4,4'-diaminostilbene-2,2'-disulphonic acid |
IUPAC Name | 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid |
InChI Key | REJHVSOVQBJEBF-OWOJBTEDSA-N |
Molecular Formula | C14H14N2O6S2 |
3-Acetylcoumarin 98.0+%, TCI America™
CAS: 3949-36-8 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.182 MDL Number: MFCD00006853 InChI Key: CSPIFKKOBWYOEX-UHFFFAOYSA-N Synonym: 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891 PubChem CID: 77553 IUPAC Name: 3-acetylchromen-2-one SMILES: CC(=O)C1=CC2=CC=CC=C2OC1=O
PubChem CID | 77553 |
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CAS | 3949-36-8 |
Molecular Weight (g/mol) | 188.182 |
MDL Number | MFCD00006853 |
SMILES | CC(=O)C1=CC2=CC=CC=C2OC1=O |
Synonym | 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891 |
IUPAC Name | 3-acetylchromen-2-one |
InChI Key | CSPIFKKOBWYOEX-UHFFFAOYSA-N |
Molecular Formula | C11H8O3 |
Disodium 4,4'-Bis(2-sulfonatostyryl)biphenyl 97.0+%, TCI America™
CAS: 27344-41-8 Molecular Formula: C28H20Na2O6S2 Molecular Weight (g/mol): 562.56 MDL Number: MFCD00318874,MFCD00318874 InChI Key: PMPJQLCPEQFEJW-GNTLFSRWSA-L PubChem CID: 87075690 IUPAC Name: disodium 2-[(1Z)-2-{4'-[(1Z)-2-(2-sulfonatophenyl)ethenyl]-[1,1'-biphenyl]-4-yl}ethenyl]benzene-1-sulfonate SMILES: [Na+].[Na+].[O-]S(=O)(=O)C1=CC=CC=C1\C=C/C1=CC=C(C=C1)C1=CC=C(\C=C/C2=CC=CC=C2S([O-])(=O)=O)C=C1
PubChem CID | 87075690 |
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CAS | 27344-41-8 |
Molecular Weight (g/mol) | 562.56 |
MDL Number | MFCD00318874,MFCD00318874 |
SMILES | [Na+].[Na+].[O-]S(=O)(=O)C1=CC=CC=C1\C=C/C1=CC=C(C=C1)C1=CC=C(\C=C/C2=CC=CC=C2S([O-])(=O)=O)C=C1 |
IUPAC Name | disodium 2-[(1Z)-2-{4'-[(1Z)-2-(2-sulfonatophenyl)ethenyl]-[1,1'-biphenyl]-4-yl}ethenyl]benzene-1-sulfonate |
InChI Key | PMPJQLCPEQFEJW-GNTLFSRWSA-L |
Molecular Formula | C28H20Na2O6S2 |
3-(3-Hydroxyphenyl)propionic acid, 98+%, Thermo Scientific Chemicals
CAS: 621-54-5 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00016554 InChI Key: QVWAEZJXDYOKEH-UHFFFAOYSA-N Synonym: 3-3-hydroxyphenyl propanoic acid,3-3-hydroxyphenyl propionic acid,dihydro-3-coumaric acid,benzenepropanoic acid, 3-hydroxy,3-m-hydroxyphenyl propionic acid,3-hydroxybenzenepropanoic acid,3-hydroxyphenylpropionic acid,m-hydroxyphenylpropionic acid,beta-m-hydroxyphenyl propionic acid,hydrocinnamic acid, m-hydroxy PubChem CID: 91 ChEBI: CHEBI:1427 IUPAC Name: 3-(3-hydroxyphenyl)propanoic acid SMILES: C1=CC(=CC(=C1)O)CCC(=O)O
PubChem CID | 91 |
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CAS | 621-54-5 |
Molecular Weight (g/mol) | 166.176 |
ChEBI | CHEBI:1427 |
MDL Number | MFCD00016554 |
SMILES | C1=CC(=CC(=C1)O)CCC(=O)O |
Synonym | 3-3-hydroxyphenyl propanoic acid,3-3-hydroxyphenyl propionic acid,dihydro-3-coumaric acid,benzenepropanoic acid, 3-hydroxy,3-m-hydroxyphenyl propionic acid,3-hydroxybenzenepropanoic acid,3-hydroxyphenylpropionic acid,m-hydroxyphenylpropionic acid,beta-m-hydroxyphenyl propionic acid,hydrocinnamic acid, m-hydroxy |
IUPAC Name | 3-(3-hydroxyphenyl)propanoic acid |
InChI Key | QVWAEZJXDYOKEH-UHFFFAOYSA-N |
Molecular Formula | C9H10O3 |
Quercetin dihydrate, 97%, Thermo Scientific Chemicals
CAS: 6151-25-3 Molecular Formula: C15H14O9 Molecular Weight (g/mol): 338.27 MDL Number: MFCD00149487 InChI Key: GMGIWEZSKCNYSW-UHFFFAOYSA-N Synonym: quercetin dihydrate,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one dihydrate,quercetine dihydrate,quercetin, dihydrate,ccris 3304,3,3',4',5,7-pentahydroxyflavone dihydrate,quercetin dihydrate sophoretin,flavone, 3,3',4',5,7-pentahydroxy-, dihydrate,dsstox_cid_1219,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-1-benzopyran-4-one dihydrate PubChem CID: 5284452 IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;dihydrate SMILES: O.O.OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1
PubChem CID | 5284452 |
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CAS | 6151-25-3 |
Molecular Weight (g/mol) | 338.27 |
MDL Number | MFCD00149487 |
SMILES | O.O.OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1 |
Synonym | quercetin dihydrate,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-chromen-4-one dihydrate,quercetine dihydrate,quercetin, dihydrate,ccris 3304,3,3',4',5,7-pentahydroxyflavone dihydrate,quercetin dihydrate sophoretin,flavone, 3,3',4',5,7-pentahydroxy-, dihydrate,dsstox_cid_1219,2-3,4-dihydroxyphenyl-3,5,7-trihydroxy-4h-1-benzopyran-4-one dihydrate |
IUPAC Name | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one;dihydrate |
InChI Key | GMGIWEZSKCNYSW-UHFFFAOYSA-N |
Molecular Formula | C15H14O9 |
Brassinazole 93.0+%, TCI America™
CAS: 224047-41-0 Molecular Formula: C18H18ClN3O Molecular Weight (g/mol): 327.81 MDL Number: MFCD08276319 InChI Key: YULDTPKHZNKFEY-UHFFFAOYNA-N Synonym: 1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole, 3-(4-Chlorophenyl)-1-methyl-1-phenyl-2-(1,2,4-triazol-1-yl)-1-propanol PubChem CID: 15477807 ChEBI: CHEBI:73177 IUPAC Name: 4-(4-chlorophenyl)-2-phenyl-3-(1H-1,2,4-triazol-1-yl)butan-2-ol SMILES: CC(O)(C(CC1=CC=C(Cl)C=C1)N1C=NC=N1)C1=CC=CC=C1
PubChem CID | 15477807 |
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CAS | 224047-41-0 |
Molecular Weight (g/mol) | 327.81 |
ChEBI | CHEBI:73177 |
MDL Number | MFCD08276319 |
SMILES | CC(O)(C(CC1=CC=C(Cl)C=C1)N1C=NC=N1)C1=CC=CC=C1 |
Synonym | 1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole, 3-(4-Chlorophenyl)-1-methyl-1-phenyl-2-(1,2,4-triazol-1-yl)-1-propanol |
IUPAC Name | 4-(4-chlorophenyl)-2-phenyl-3-(1H-1,2,4-triazol-1-yl)butan-2-ol |
InChI Key | YULDTPKHZNKFEY-UHFFFAOYNA-N |
Molecular Formula | C18H18ClN3O |
3,5-Dimethoxy-4-hydroxycinnamic Acid 98.0+%, TCI America™
CAS: 530-59-6 Molecular Formula: C11H12O5 Molecular Weight (g/mol): 224.212 MDL Number: MFCD00004401 InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N Synonym: sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec PubChem CID: 637775 ChEBI: CHEBI:15714 IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O
PubChem CID | 637775 |
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CAS | 530-59-6 |
Molecular Weight (g/mol) | 224.212 |
ChEBI | CHEBI:15714 |
MDL Number | MFCD00004401 |
SMILES | COC1=CC(=CC(=C1O)OC)C=CC(=O)O |
Synonym | sinapic acid,sinapinic acid,3,5-dimethoxy-4-hydroxycinnamic acid,sinapinate,sinapate,trans-sinapic acid,4-hydroxy-3,5-dimethoxycinnamic acid,synapoic acid,2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid,unii-p0i60993ec |
IUPAC Name | (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid |
InChI Key | PCMORTLOPMLEFB-ONEGZZNKSA-N |
Molecular Formula | C11H12O5 |
2,5-Dimethoxycinnamic Acid 97.0+%, TCI America™
CAS: 10538-51-9 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00004378 InChI Key: JPQWWJZORKTMIZ-ZZXKWVIFSA-N Synonym: 2,5-dimethoxycinnamic acid,3-2,5-dimethoxyphenyl acrylic acid,e-3-2,5-dimethoxyphenyl acrylic acid,2e-3-2,5-dimethoxyphenyl acrylic acid,3-2,5-dimethoxyphenyl-2-propenoic acid,2e-3-2,5-dimethoxyphenyl prop-2-enoic acid,3-2,5-dimethoxyphenyl prop-2-enoic acid,rarechem bk hc t324,timtec-bb sbb000471,trans-2,5-dimethoxycinnamic acid PubChem CID: 697594 IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid SMILES: COC1=CC(=C(C=C1)OC)C=CC(=O)O
PubChem CID | 697594 |
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CAS | 10538-51-9 |
Molecular Weight (g/mol) | 208.213 |
MDL Number | MFCD00004378 |
SMILES | COC1=CC(=C(C=C1)OC)C=CC(=O)O |
Synonym | 2,5-dimethoxycinnamic acid,3-2,5-dimethoxyphenyl acrylic acid,e-3-2,5-dimethoxyphenyl acrylic acid,2e-3-2,5-dimethoxyphenyl acrylic acid,3-2,5-dimethoxyphenyl-2-propenoic acid,2e-3-2,5-dimethoxyphenyl prop-2-enoic acid,3-2,5-dimethoxyphenyl prop-2-enoic acid,rarechem bk hc t324,timtec-bb sbb000471,trans-2,5-dimethoxycinnamic acid |
IUPAC Name | (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid |
InChI Key | JPQWWJZORKTMIZ-ZZXKWVIFSA-N |
Molecular Formula | C11H12O4 |
3-(3,4-Dimethoxyphenyl)propionic Acid 98.0+%, TCI America™
CAS: 2107-70-2 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.229 MDL Number: MFCD00002774 InChI Key: LHHKQWQTBCTDQM-UHFFFAOYSA-N Synonym: 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid PubChem CID: 75019 ChEBI: CHEBI:44235 IUPAC Name: 3-(3,4-dimethoxyphenyl)propanoic acid SMILES: COC1=C(C=C(C=C1)CCC(=O)O)OC
PubChem CID | 75019 |
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CAS | 2107-70-2 |
Molecular Weight (g/mol) | 210.229 |
ChEBI | CHEBI:44235 |
MDL Number | MFCD00002774 |
SMILES | COC1=C(C=C(C=C1)CCC(=O)O)OC |
Synonym | 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid |
IUPAC Name | 3-(3,4-dimethoxyphenyl)propanoic acid |
InChI Key | LHHKQWQTBCTDQM-UHFFFAOYSA-N |
Molecular Formula | C11H14O4 |
1,3-Diphenylacetone p-Toluenesulfonylhydrazone 98.0+%, TCI America™
CAS: 19816-88-7 Molecular Formula: C22H22N2O2S Molecular Weight (g/mol): 378.49 MDL Number: MFCD00009645 InChI Key: GDXUEUWCUUAZFM-UHFFFAOYSA-N Synonym: 1,3-diphenylacetone p-toluenesulfonylhydrazone,1,3-diphenylacetone p-tosylhydrazone,1,3-diphenyl-2-propanone tosylhydrazone,1,3-diphenylpropan-2-one tosylhydrazone,n'-1,3-diphenylpropan-2-ylidene-4-methylbenzenesulfonohydrazide,1,3-diphenyl-2-propanone p-tosylhydrazone,n-1,3-diphenylpropan-2-ylideneamino-4-methylbenzenesulfonamide,acmc-209f2n,dibenzyl ketone tosyl hydrazone,benzenesulfonic acid, 4-methyl-, 2-phenyl-1-phenylmethyl ethylidene hydrazide PubChem CID: 88263 IUPAC Name: N'-(1,3-diphenylpropan-2-ylidene)-4-methylbenzene-1-sulfonohydrazide SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=C(CC1=CC=CC=C1)CC1=CC=CC=C1
PubChem CID | 88263 |
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CAS | 19816-88-7 |
Molecular Weight (g/mol) | 378.49 |
MDL Number | MFCD00009645 |
SMILES | CC1=CC=C(C=C1)S(=O)(=O)NN=C(CC1=CC=CC=C1)CC1=CC=CC=C1 |
Synonym | 1,3-diphenylacetone p-toluenesulfonylhydrazone,1,3-diphenylacetone p-tosylhydrazone,1,3-diphenyl-2-propanone tosylhydrazone,1,3-diphenylpropan-2-one tosylhydrazone,n'-1,3-diphenylpropan-2-ylidene-4-methylbenzenesulfonohydrazide,1,3-diphenyl-2-propanone p-tosylhydrazone,n-1,3-diphenylpropan-2-ylideneamino-4-methylbenzenesulfonamide,acmc-209f2n,dibenzyl ketone tosyl hydrazone,benzenesulfonic acid, 4-methyl-, 2-phenyl-1-phenylmethyl ethylidene hydrazide |
IUPAC Name | N'-(1,3-diphenylpropan-2-ylidene)-4-methylbenzene-1-sulfonohydrazide |
InChI Key | GDXUEUWCUUAZFM-UHFFFAOYSA-N |
Molecular Formula | C22H22N2O2S |
trans-2,4-Dichlorocinnamic Acid 98.0+%, TCI America™
CAS: 20595-45-3 Molecular Formula: C9H6Cl2O2 Molecular Weight (g/mol): 217.045 MDL Number: MFCD00004373 InChI Key: MEBWABJHRAYGFW-DUXPYHPUSA-N Synonym: 2,4-dichlorocinnamic acid,trans-2,4-dichlorocinnamic acid,e-3-2,4-dichlorophenyl acrylic acid,cinnamic acid, 2,4-dichloro,3-2,4-dichlorophenyl-2-propenoic acid,unii-c09kk5d2t2,2-propenoic acid, 3-2,4-dichlorophenyl-, 2e,2e-3-2,4-dichlorophenyl acrylic acid,2-propenoic acid, 3-2,4-dichlorophenyl,2e-3-2,4-dichlorophenyl prop-2-enoic acid PubChem CID: 688026 IUPAC Name: (E)-3-(2,4-dichlorophenyl)prop-2-enoic acid SMILES: C1=CC(=C(C=C1Cl)Cl)C=CC(=O)O
PubChem CID | 688026 |
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CAS | 20595-45-3 |
Molecular Weight (g/mol) | 217.045 |
MDL Number | MFCD00004373 |
SMILES | C1=CC(=C(C=C1Cl)Cl)C=CC(=O)O |
Synonym | 2,4-dichlorocinnamic acid,trans-2,4-dichlorocinnamic acid,e-3-2,4-dichlorophenyl acrylic acid,cinnamic acid, 2,4-dichloro,3-2,4-dichlorophenyl-2-propenoic acid,unii-c09kk5d2t2,2-propenoic acid, 3-2,4-dichlorophenyl-, 2e,2e-3-2,4-dichlorophenyl acrylic acid,2-propenoic acid, 3-2,4-dichlorophenyl,2e-3-2,4-dichlorophenyl prop-2-enoic acid |
IUPAC Name | (E)-3-(2,4-dichlorophenyl)prop-2-enoic acid |
InChI Key | MEBWABJHRAYGFW-DUXPYHPUSA-N |
Molecular Formula | C9H6Cl2O2 |
Pentafluorophenyl 4-(tetrahydropyran-4-yloxy)benzoate, 97%, Thermo Scientific™
CAS: 930110-97-7 Molecular Formula: C18H13F5O4 Molecular Weight (g/mol): 388.29 MDL Number: MFCD09702368 InChI Key: BDWCEFHYQPZQRO-UHFFFAOYSA-N Synonym: pentafluorophenyl 4-tetrahydropyran-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 4-oxan-4-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-oxan-4-yloxy benzoate,4-4-oxanyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229528 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 4-(oxan-4-yloxy)benzoate SMILES: FC1=C(F)C(F)=C(OC(=O)C2=CC=C(OC3CCOCC3)C=C2)C(F)=C1F
PubChem CID | 24229528 |
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CAS | 930110-97-7 |
Molecular Weight (g/mol) | 388.29 |
MDL Number | MFCD09702368 |
SMILES | FC1=C(F)C(F)=C(OC(=O)C2=CC=C(OC3CCOCC3)C=C2)C(F)=C1F |
Synonym | pentafluorophenyl 4-tetrahydropyran-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yloxy benzoate,pentafluorophenyl 4-oxan-4-yl oxy benzoate,2,3,4,5,6-pentafluorophenyl 4-oxan-4-yloxy benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-oxan-4-yloxy benzoate,4-4-oxanyloxy benzoic acid 2,3,4,5,6-pentafluorophenyl ester |
IUPAC Name | (2,3,4,5,6-pentafluorophenyl) 4-(oxan-4-yloxy)benzoate |
InChI Key | BDWCEFHYQPZQRO-UHFFFAOYSA-N |
Molecular Formula | C18H13F5O4 |
Pentafluorophenyl 3-(1-methyl-1H-pyrazol-3-yl)benzoate, 97%, Thermo Scientific™
CAS: 910037-11-5 Molecular Formula: C17H9F5N2O2 Molecular Weight (g/mol): 368.263 MDL Number: MFCD09065010 InChI Key: LGHVUZDAZTZCHC-UHFFFAOYSA-N Synonym: pentafluorophenyl 3-1-methyl-1h-pyrazol-3-yl benzoate,2,3,4,5,6-pentafluorophenyl 3-1-methylpyrazol-3-yl benzoate,pentafluorophenyl 3-1-methylpyrazol-3-yl benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 3-1-methylpyrazol-3-yl benzoate,3-1-methyl-3-pyrazolyl benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229633 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 3-(1-methylpyrazol-3-yl)benzoate SMILES: CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F
PubChem CID | 24229633 |
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CAS | 910037-11-5 |
Molecular Weight (g/mol) | 368.263 |
MDL Number | MFCD09065010 |
SMILES | CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F |
Synonym | pentafluorophenyl 3-1-methyl-1h-pyrazol-3-yl benzoate,2,3,4,5,6-pentafluorophenyl 3-1-methylpyrazol-3-yl benzoate,pentafluorophenyl 3-1-methylpyrazol-3-yl benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 3-1-methylpyrazol-3-yl benzoate,3-1-methyl-3-pyrazolyl benzoic acid 2,3,4,5,6-pentafluorophenyl ester |
IUPAC Name | (2,3,4,5,6-pentafluorophenyl) 3-(1-methylpyrazol-3-yl)benzoate |
InChI Key | LGHVUZDAZTZCHC-UHFFFAOYSA-N |
Molecular Formula | C17H9F5N2O2 |
Pentafluorophenyl 4-(3,5-dimethyl-1H-pyrazol-1-yl)benzoate, 97%, Thermo Scientific™
CAS: 941717-00-6 Molecular Formula: C18H11F5N2O2 Molecular Weight (g/mol): 382.29 MDL Number: MFCD09879978 InChI Key: GQQALUKKLLEHOR-UHFFFAOYSA-N Synonym: pentafluorophenyl 4-3,5-dimethyl-1h-pyrazol-1-yl benzoate,2,3,4,5,6-pentafluorophenyl 4-3,5-dimethylpyrazol-1-yl benzoate,pentafluorophenyl 4-3,5-dimethylpyrazol-1-yl benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-3,5-dimethylpyrazol-1-yl benzoate,4-3,5-dimethyl-1-pyrazolyl benzoic acid 2,3,4,5,6-pentafluorophenyl ester PubChem CID: 24229762 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate SMILES: CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F)C
PubChem CID | 24229762 |
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CAS | 941717-00-6 |
Molecular Weight (g/mol) | 382.29 |
MDL Number | MFCD09879978 |
SMILES | CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C(=C3F)F)F)F)F)C |
Synonym | pentafluorophenyl 4-3,5-dimethyl-1h-pyrazol-1-yl benzoate,2,3,4,5,6-pentafluorophenyl 4-3,5-dimethylpyrazol-1-yl benzoate,pentafluorophenyl 4-3,5-dimethylpyrazol-1-yl benzoate,2,3,4,5,6-pentakis fluoranyl phenyl 4-3,5-dimethylpyrazol-1-yl benzoate,4-3,5-dimethyl-1-pyrazolyl benzoic acid 2,3,4,5,6-pentafluorophenyl ester |
IUPAC Name | (2,3,4,5,6-pentafluorophenyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate |
InChI Key | GQQALUKKLLEHOR-UHFFFAOYSA-N |
Molecular Formula | C18H11F5N2O2 |