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Carbonyl compounds

Organic compounds that contain one or more carbonyl (a carbon atom with a double bond to an oxygen atom) functional groups. Includes compounds with functional groups that contain a carbonyl in their structure such as ketones, aldehydes, and others.
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D-(+)-Maltose Monohydrate, Fisher BioReagents

CAS: 6363-53-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00149343 InChI Key: HBDJFVFTHLOSDW-UHFFFAOYNA-N Synonym: d-+-maltose monohydrate,unii-dm477ee40d,2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate,beta-maltose monohydrate,d-+-maltosemonohydrate,69-79-4 anhydrous,d +-maltose monohydrate,d-+-maltose monohydrate, puriss.,d-+-maltose monohydrate, analytical standard,d-+-maltose monohydrate, bioxtra IUPAC Name: 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate SMILES: O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O

CAS 6363-53-7
Molecular Weight (g/mol) 360.31
MDL Number MFCD00149343
SMILES O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O
Synonym d-+-maltose monohydrate,unii-dm477ee40d,2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate,beta-maltose monohydrate,d-+-maltosemonohydrate,69-79-4 anhydrous,d +-maltose monohydrate,d-+-maltose monohydrate, puriss.,d-+-maltose monohydrate, analytical standard,d-+-maltose monohydrate, bioxtra
IUPAC Name 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate
InChI Key HBDJFVFTHLOSDW-UHFFFAOYNA-N
Molecular Formula C12H24O12
2

2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde, 97%, Thermo Scientific™

CAS: 38002-88-9 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.22 MDL Number: MFCD04115387 InChI Key: HGKYVFOYQUSRQN-UHFFFAOYSA-N Synonym: 2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzofuran-7-carbaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro-2,2-dimethyl,2,2-dimethyl-7-formyl-2,3-dihydrobenzofuran,2,2-dimethyl-2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzo b furan-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carboxaldehyde,2,2-dimethyl-2,3-dihydro-1-benzo b furan-7-carbaldehyde PubChem CID: 2795471 SMILES: CC1(C)CC2=CC=CC(C=O)=C2O1

PubChem CID 2795471
CAS 38002-88-9
Molecular Weight (g/mol) 176.22
MDL Number MFCD04115387
SMILES CC1(C)CC2=CC=CC(C=O)=C2O1
Synonym 2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzofuran-7-carbaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro-2,2-dimethyl,2,2-dimethyl-7-formyl-2,3-dihydrobenzofuran,2,2-dimethyl-2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzo b furan-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carboxaldehyde,2,2-dimethyl-2,3-dihydro-1-benzo b furan-7-carbaldehyde
InChI Key HGKYVFOYQUSRQN-UHFFFAOYSA-N
Molecular Formula C11H12O2
3

Tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionato)niobium(IV), Thermo Scientific™

CAS: 41706-15-4 Molecular Formula: C44H80NbO8 Molecular Weight (g/mol): 830.022 MDL Number: MFCD00145379 InChI Key: WYTIGJVEVROCSD-DSORRXEFSA-N Synonym: tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato niobium iv,nb tmhd 4,niobium tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionate,4e-5-bis 3e-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy niobio oxy-2,2,6,6-tetramethylhept-4-en-3-one PubChem CID: 72376395 IUPAC Name: (Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;(E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;niobium SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Nb]

PubChem CID 72376395
CAS 41706-15-4
Molecular Weight (g/mol) 830.022
MDL Number MFCD00145379
SMILES CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Nb]
Synonym tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato niobium iv,nb tmhd 4,niobium tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionate,4e-5-bis 3e-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy niobio oxy-2,2,6,6-tetramethylhept-4-en-3-one
IUPAC Name (Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;(E)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;niobium
InChI Key WYTIGJVEVROCSD-DSORRXEFSA-N
Molecular Formula C44H80NbO8
4

Ethacrynic acid

CAS: 58-54-8 Molecular Formula: C13H12Cl2O4 Molecular Weight (g/mol): 303.135 MDL Number: MFCD00056693 InChI Key: AVOLMBLBETYQHX-UHFFFAOYSA-N Synonym: ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril PubChem CID: 3278 ChEBI: CHEBI:4876 IUPAC Name: 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid SMILES: CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl

PubChem CID 3278
CAS 58-54-8
Molecular Weight (g/mol) 303.135
ChEBI CHEBI:4876
MDL Number MFCD00056693
SMILES CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl
Synonym ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril
IUPAC Name 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid
InChI Key AVOLMBLBETYQHX-UHFFFAOYSA-N
Molecular Formula C13H12Cl2O4
5

Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)gadolinium(III)

CAS: 14768-15-1 Molecular Formula: C33H57GdO6 Molecular Weight (g/mol): 707.06 MDL Number: MFCD00010349 InChI Key: UIVVGOMXFUOLAN-UHFFFAOYSA-N Synonym: tris 2,2,6,6-tetramethyl-3,5-heptanedionate gadolinium PubChem CID: 132984032 IUPAC Name: gadolinium;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: [Gd+3].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C

PubChem CID 132984032
CAS 14768-15-1
Molecular Weight (g/mol) 707.06
MDL Number MFCD00010349
SMILES [Gd+3].CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C.CC(C)(C)C(=O)[CH-]C(=O)C(C)(C)C
Synonym tris 2,2,6,6-tetramethyl-3,5-heptanedionate gadolinium
IUPAC Name gadolinium;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one
InChI Key UIVVGOMXFUOLAN-UHFFFAOYSA-N
Molecular Formula C33H57GdO6
6

3-Methyl-3-trimethylsiloxy-1-butyne, 97%

CAS: 17869-77-1 Molecular Formula: C8H16OSi Molecular Weight (g/mol): 156.3 MDL Number: MFCD00053867 InChI Key: JNRUXZIXAXHXTN-UHFFFAOYSA-N Synonym: 3-methyl-3-trimethylsilyloxy-1-butyne,trimethyl 2-methylbut-3-yn-2-yloxy silane,trimethyl 2-methylbut-3-yn-2-yl oxy silane,1,1-dimethyl-2-propynyl oxy trimethylsilane,3-methyl-3-trimethylsiloxy-1-butyne,acmc-1brai,silane, 1,1-dimethyl-2-propynyl oxy trimethyl,3-trimethylsiloxy-3-methyl-1-butyne PubChem CID: 87344 IUPAC Name: trimethyl(2-methylbut-3-yn-2-yloxy)silane SMILES: CC(C)(C#C)O[Si](C)(C)C

PubChem CID 87344
CAS 17869-77-1
Molecular Weight (g/mol) 156.3
MDL Number MFCD00053867
SMILES CC(C)(C#C)O[Si](C)(C)C
Synonym 3-methyl-3-trimethylsilyloxy-1-butyne,trimethyl 2-methylbut-3-yn-2-yloxy silane,trimethyl 2-methylbut-3-yn-2-yl oxy silane,1,1-dimethyl-2-propynyl oxy trimethylsilane,3-methyl-3-trimethylsiloxy-1-butyne,acmc-1brai,silane, 1,1-dimethyl-2-propynyl oxy trimethyl,3-trimethylsiloxy-3-methyl-1-butyne
IUPAC Name trimethyl(2-methylbut-3-yn-2-yloxy)silane
InChI Key JNRUXZIXAXHXTN-UHFFFAOYSA-N
Molecular Formula C8H16OSi
7
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2,2,2,3'-Tetrafluoroacetophenone, 98%

CAS: 708-64-5 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.11 MDL Number: MFCD00039236 InChI Key: NQSPTMFCJGKOQJ-UHFFFAOYSA-N Synonym: 2,2,2,3'-tetrafluoroacetophenone,2,2,2-trifluoro-1-3-fluorophenyl ethanone,m-fluorotrifluoroacetophenone,acetophenone, 2,2,2,3'-tetrafluoro,2,2,2-trifluoro-1-3-fluorophenyl ethan-1-one,ethanone, 2,2,2-trifluoro-1-3-fluorophenyl,ethanone,2,2,2-trifluoro-1-3-fluorophenyl,acmc-20aol4,m,alpha,alpha,alpha-tetrafluoroacetophenone,2,2,2,3'-trtrafluoroacetophenone PubChem CID: 69723 IUPAC Name: 2,2,2-trifluoro-1-(3-fluorophenyl)ethanone SMILES: FC1=CC=CC(=C1)C(=O)C(F)(F)F

PubChem CID 69723
CAS 708-64-5
Molecular Weight (g/mol) 192.11
MDL Number MFCD00039236
SMILES FC1=CC=CC(=C1)C(=O)C(F)(F)F
Synonym 2,2,2,3'-tetrafluoroacetophenone,2,2,2-trifluoro-1-3-fluorophenyl ethanone,m-fluorotrifluoroacetophenone,acetophenone, 2,2,2,3'-tetrafluoro,2,2,2-trifluoro-1-3-fluorophenyl ethan-1-one,ethanone, 2,2,2-trifluoro-1-3-fluorophenyl,ethanone,2,2,2-trifluoro-1-3-fluorophenyl,acmc-20aol4,m,alpha,alpha,alpha-tetrafluoroacetophenone,2,2,2,3'-trtrafluoroacetophenone
IUPAC Name 2,2,2-trifluoro-1-(3-fluorophenyl)ethanone
InChI Key NQSPTMFCJGKOQJ-UHFFFAOYSA-N
Molecular Formula C8H4F4O
8
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Methyl 3-trifluoromethylbenzoylacetate, 95%, Thermo Scientific™

CAS: 93618-66-7 Molecular Formula: C11H9F3O3 Molecular Weight (g/mol): 246.19 MDL Number: MFCD00216522 InChI Key: RPRMYRPHNDGZOY-UHFFFAOYSA-N Synonym: methyl 3-oxo-3-3-trifluoromethyl phenyl propanoate,methyl 3-trifluoromethyl benzoylacetate,methyl 3-trifluoromethyl benzoyl acetate,3-3-trifluoromethylphenyl-3-oxo-propionic acid methyl ester,3-oxo-3-3-trifluoromethyl-phenyl-propionic acid methyl ester,pubchem2695,methyl 3-trifluoromethylbenzoylacetate,methyl 3-oxo-3-3-trifluoromethylphenyl propanoate,3-oxo-3-3-trifluoromethylphenyl propionic acid methyl ester PubChem CID: 735880 IUPAC Name: methyl 3-oxo-3-[3-(trifluoromethyl)phenyl]propanoate SMILES: COC(=O)CC(=O)C1=CC=CC(=C1)C(F)(F)F

PubChem CID 735880
CAS 93618-66-7
Molecular Weight (g/mol) 246.19
MDL Number MFCD00216522
SMILES COC(=O)CC(=O)C1=CC=CC(=C1)C(F)(F)F
Synonym methyl 3-oxo-3-3-trifluoromethyl phenyl propanoate,methyl 3-trifluoromethyl benzoylacetate,methyl 3-trifluoromethyl benzoyl acetate,3-3-trifluoromethylphenyl-3-oxo-propionic acid methyl ester,3-oxo-3-3-trifluoromethyl-phenyl-propionic acid methyl ester,pubchem2695,methyl 3-trifluoromethylbenzoylacetate,methyl 3-oxo-3-3-trifluoromethylphenyl propanoate,3-oxo-3-3-trifluoromethylphenyl propionic acid methyl ester
IUPAC Name methyl 3-oxo-3-[3-(trifluoromethyl)phenyl]propanoate
InChI Key RPRMYRPHNDGZOY-UHFFFAOYSA-N
Molecular Formula C11H9F3O3
9
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Ethyl isonicotinoylacetate, 95%

CAS: 26377-17-3 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00094021 InChI Key: PCJNYGPKMQQCPX-UHFFFAOYSA-N Synonym: ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester PubChem CID: 2735202 IUPAC Name: ethyl 3-oxo-3-pyridin-4-ylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=NC=C1

PubChem CID 2735202
CAS 26377-17-3
Molecular Weight (g/mol) 193.20
MDL Number MFCD00094021
SMILES CCOC(=O)CC(=O)C1=CC=NC=C1
Synonym ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester
IUPAC Name ethyl 3-oxo-3-pyridin-4-ylpropanoate
InChI Key PCJNYGPKMQQCPX-UHFFFAOYSA-N
Molecular Formula C10H11NO3
10
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Methyl nicotinoylacetate, 95%

CAS: 54950-20-8 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.18 MDL Number: MFCD00216524 InChI Key: JUQKVXRLRKKRPL-UHFFFAOYSA-N Synonym: methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate PubChem CID: 108645 IUPAC Name: methyl 3-oxo-3-pyridin-3-ylpropanoate SMILES: COC(=O)CC(=O)C1=CC=CN=C1

PubChem CID 108645
CAS 54950-20-8
Molecular Weight (g/mol) 179.18
MDL Number MFCD00216524
SMILES COC(=O)CC(=O)C1=CC=CN=C1
Synonym methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate
IUPAC Name methyl 3-oxo-3-pyridin-3-ylpropanoate
InChI Key JUQKVXRLRKKRPL-UHFFFAOYSA-N
Molecular Formula C9H9NO3
11
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1,1,1-Trifluoro-5-methyl-2,4-hexanedione, 97%, Thermo Scientific™

CAS: 30984-28-2 Molecular Formula: C7H9F3O2 Molecular Weight (g/mol): 182.14 MDL Number: MFCD00045106 InChI Key: QDJWKASBKAMIDF-ZZXKWVIFSA-N Synonym: 1,1,1-trifluoro-5-methyl-2,4-hexanedione,trifluoroacetyl isobutyrylmethane,2,4-hexanedione, 1,1,1-trifluoro-5-methyl,5-methyl-1,1,1-trifluoro-2,4-hexanedione,2,4-hexanedione,1,1,1-trifluoro-5-methyl,tos-bb-0654,2,4-dioxo-5-methyl-1,1,1-trifluorohexane,5-methyl-1,1,1-trifluorohexane-2,4-dione PubChem CID: 160191 IUPAC Name: 1,1,1-trifluoro-5-methylhexane-2,4-dione SMILES: CC(C)C(=O)\C=C(\O)C(F)(F)F

PubChem CID 160191
CAS 30984-28-2
Molecular Weight (g/mol) 182.14
MDL Number MFCD00045106
SMILES CC(C)C(=O)\C=C(\O)C(F)(F)F
Synonym 1,1,1-trifluoro-5-methyl-2,4-hexanedione,trifluoroacetyl isobutyrylmethane,2,4-hexanedione, 1,1,1-trifluoro-5-methyl,5-methyl-1,1,1-trifluoro-2,4-hexanedione,2,4-hexanedione,1,1,1-trifluoro-5-methyl,tos-bb-0654,2,4-dioxo-5-methyl-1,1,1-trifluorohexane,5-methyl-1,1,1-trifluorohexane-2,4-dione
IUPAC Name 1,1,1-trifluoro-5-methylhexane-2,4-dione
InChI Key QDJWKASBKAMIDF-ZZXKWVIFSA-N
Molecular Formula C7H9F3O2
12
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2-(4-Methoxybenzoyl)thiophene, 97%

CAS: 4160-63-8 Molecular Formula: C12H10O2S Molecular Weight (g/mol): 218.27 MDL Number: MFCD00005440 InChI Key: KYVBFEMQEUXVQB-UHFFFAOYSA-N Synonym: 2-4-methoxybenzoyl thiophene,4-methoxyphenyl thiophen-2-yl methanone,2-p-methoxybenzoyl thiophene,p-anisyl thiophen-2-yl ketone,4-methoxyphenyl 2-thienyl ketone,methanone, 4-methoxyphenyl-2-thienyl,4-methoxyphenyl 2-thienyl methanone,pubchem10833,acmc-1aikh,2-thienyl p-anisyl ketone PubChem CID: 77812 IUPAC Name: (4-methoxyphenyl)-thiophen-2-ylmethanone SMILES: COC1=CC=C(C=C1)C(=O)C2=CC=CS2

PubChem CID 77812
CAS 4160-63-8
Molecular Weight (g/mol) 218.27
MDL Number MFCD00005440
SMILES COC1=CC=C(C=C1)C(=O)C2=CC=CS2
Synonym 2-4-methoxybenzoyl thiophene,4-methoxyphenyl thiophen-2-yl methanone,2-p-methoxybenzoyl thiophene,p-anisyl thiophen-2-yl ketone,4-methoxyphenyl 2-thienyl ketone,methanone, 4-methoxyphenyl-2-thienyl,4-methoxyphenyl 2-thienyl methanone,pubchem10833,acmc-1aikh,2-thienyl p-anisyl ketone
IUPAC Name (4-methoxyphenyl)-thiophen-2-ylmethanone
InChI Key KYVBFEMQEUXVQB-UHFFFAOYSA-N
Molecular Formula C12H10O2S
13

5-(Bromoacetyl)-2-oxoindoline, 97%, Thermo Scientific™

CAS: 105316-98-1 Molecular Formula: C10H8BrNO2 Molecular Weight (g/mol): 254.083 MDL Number: MFCD08690294 InChI Key: WHLZVVMOQHTDAX-UHFFFAOYSA-N Synonym: 5-bromoacetyl-2-oxoindoline,5-2-bromoacetyl indolin-2-one,5-bromoacetyl-1,3-dihydro-2h-indol-2-one,5-2-bromoacetyl-1,3-dihydroindol-2-one,2h-indol-2-one,5-2-bromoacetyl-1,3-dihydro,5-bromoacetyloxindole,acmc-20a59p,5-alpha-bromoacetyl oxindole,5-2-bromoacetyl-2-indolinone,2h-indol-2-one, 5-bromoacetyl-1,3-dihydro PubChem CID: 22099309 IUPAC Name: 5-(2-bromoacetyl)-1,3-dihydroindol-2-one SMILES: C1C2=C(C=CC(=C2)C(=O)CBr)NC1=O

PubChem CID 22099309
CAS 105316-98-1
Molecular Weight (g/mol) 254.083
MDL Number MFCD08690294
SMILES C1C2=C(C=CC(=C2)C(=O)CBr)NC1=O
Synonym 5-bromoacetyl-2-oxoindoline,5-2-bromoacetyl indolin-2-one,5-bromoacetyl-1,3-dihydro-2h-indol-2-one,5-2-bromoacetyl-1,3-dihydroindol-2-one,2h-indol-2-one,5-2-bromoacetyl-1,3-dihydro,5-bromoacetyloxindole,acmc-20a59p,5-alpha-bromoacetyl oxindole,5-2-bromoacetyl-2-indolinone,2h-indol-2-one, 5-bromoacetyl-1,3-dihydro
IUPAC Name 5-(2-bromoacetyl)-1,3-dihydroindol-2-one
InChI Key WHLZVVMOQHTDAX-UHFFFAOYSA-N
Molecular Formula C10H8BrNO2
14
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7-Methoxy-1-indanone, 95%

CAS: 34985-41-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD06659666 InChI Key: CZXBVBATQPHSSL-UHFFFAOYSA-N PubChem CID: 288143 IUPAC Name: 7-methoxy-2,3-dihydroinden-1-one SMILES: COC1=CC=CC2=C1C(=O)CC2

PubChem CID 288143
CAS 34985-41-6
Molecular Weight (g/mol) 162.188
MDL Number MFCD06659666
SMILES COC1=CC=CC2=C1C(=O)CC2
IUPAC Name 7-methoxy-2,3-dihydroinden-1-one
InChI Key CZXBVBATQPHSSL-UHFFFAOYSA-N
Molecular Formula C10H10O2
15
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2-(2-Nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione, 95%

CAS: 104206-65-7 Molecular Formula: C14H10F3NO5 Molecular Weight (g/mol): 329.231 MDL Number: MFCD01752192 InChI Key: OUBCNLGXQFSTLU-UHFFFAOYSA-N Synonym: nitisinone,orfadin,nitisone,ntbc,2-2-nitro-4-trifluoromethyl benzoyl cyclohexane-1,3-dione,2-2-nitro-4-trifluoromethylbenzoyl-1,3-cyclohexanedione,nitisinone usan:inn,nitisinone inn,nitisinona PubChem CID: 115355 ChEBI: CHEBI:50378 IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione SMILES: C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

PubChem CID 115355
CAS 104206-65-7
Molecular Weight (g/mol) 329.231
ChEBI CHEBI:50378
MDL Number MFCD01752192
SMILES C1CC(=O)C(C(=O)C1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]
Synonym nitisinone,orfadin,nitisone,ntbc,2-2-nitro-4-trifluoromethyl benzoyl cyclohexane-1,3-dione,2-2-nitro-4-trifluoromethylbenzoyl-1,3-cyclohexanedione,nitisinone usan:inn,nitisinone inn,nitisinona
IUPAC Name 2-[2-nitro-4-(trifluoromethyl)benzoyl]cyclohexane-1,3-dione
InChI Key OUBCNLGXQFSTLU-UHFFFAOYSA-N
Molecular Formula C14H10F3NO5