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Phenylpropanoids and polyketides

Phenylpropaniods are organic compounds characterized by having an aromatic ring and a three-carbon propene tail. Polyketides are compounds characterized by having two or more carbonyl functional groups connected with a single carbon atom.
Acides cinnamiques et dérivés (267)
Coumarines et dérivés (263)
Flavonoïdes (174)
Acides phénylpropanoïques (166)
1,3-diarylpropanoïdes linéaires (140)
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Cinnamaldéhydes (42)
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Lactames macrolides (4)
Macrolactames (3)
Macrolides et analogues (2)
Néoflavonoïdes (2)
Angucyclines (1)
Ochratoxines et substances connexes (1)

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1

4,4'-Diaminostilbene-2,2'-disulfonic acid, 95%

CAS: 81-11-8 Formule moléculaire: C14H14N2O6S2 Poids moléculaire (g/mol): 370.394 Numéro MDL: MFCD00024946 Clé InChI: REJHVSOVQBJEBF-OWOJBTEDSA-N Synonyme: 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 CID PubChem: 5284378 Nom IUPAC: 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

Poids moléculaire (g/mol) 370.394
Synonyme 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
Numéro MDL MFCD00024946
CAS 81-11-8
CID PubChem 5284378
Nom IUPAC 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid
Clé InChI REJHVSOVQBJEBF-OWOJBTEDSA-N
SMILES C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O
Formule moléculaire C14H14N2O6S2
2

Benzoin, 98%

CAS: 119-53-9 Formule moléculaire: C14H12O2 Poids moléculaire (g/mol): 212.25 Numéro MDL: MFCD00004496 Clé InChI: ISAOCJYIOMOJEB-UHFFFAOYNA-N Synonyme: benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone CID PubChem: 8400 ChEBI: CHEBI:17682 Nom IUPAC: 2-hydroxy-1,2-diphenylethanone SMILES: OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

Poids moléculaire (g/mol) 212.25
Synonyme benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone
Numéro MDL MFCD00004496
CAS 119-53-9
CID PubChem 8400
ChEBI CHEBI:17682
Nom IUPAC 2-hydroxy-1,2-diphenylethanone
Clé InChI ISAOCJYIOMOJEB-UHFFFAOYNA-N
SMILES OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
Formule moléculaire C14H12O2
3

Anisoin, 97%

CAS: 119-52-8 Formule moléculaire: C16H16O4 Poids moléculaire (g/mol): 272.30 Numéro MDL: MFCD00008411 Clé InChI: LRRQSCPPOIUNGX-UHFFFAOYNA-N Synonyme: anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one CID PubChem: 95415 Nom IUPAC: 2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1

Poids moléculaire (g/mol) 272.30
Synonyme anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one
Numéro MDL MFCD00008411
CAS 119-52-8
CID PubChem 95415
Nom IUPAC 2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
Clé InChI LRRQSCPPOIUNGX-UHFFFAOYNA-N
SMILES COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1
Formule moléculaire C16H16O4
4

Benzoin, 99%

CAS: 119-53-9 Formule moléculaire: C14H12O2 Poids moléculaire (g/mol): 212.25 Numéro MDL: MFCD00004496 Clé InChI: ISAOCJYIOMOJEB-UHFFFAOYNA-N Synonyme: benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone CID PubChem: 8400 ChEBI: CHEBI:17682 Nom IUPAC: 2-hydroxy-1,2-diphenylethanone SMILES: OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

Poids moléculaire (g/mol) 212.25
Synonyme benzoin,2-hydroxy-2-phenylacetophenone,benzoylphenylcarbinol,benzoin tincture,+--benzoin,ethanone, 2-hydroxy-1,2-diphenyl,bitter almond oil camphor,phenylbenzoyl carbinol,2-hydroxy-1,2-diphenylethan-1-one,alpha-hydroxybenzyl phenyl ketone
Numéro MDL MFCD00004496
CAS 119-53-9
CID PubChem 8400
ChEBI CHEBI:17682
Nom IUPAC 2-hydroxy-1,2-diphenylethanone
Clé InChI ISAOCJYIOMOJEB-UHFFFAOYNA-N
SMILES OC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
Formule moléculaire C14H12O2
5

Benzoin methyl ether, 97%

CAS: 3524-62-7 Formule moléculaire: C15H14O2 Poids moléculaire (g/mol): 226.275 Numéro MDL: MFCD00008492 Clé InChI: BQZJOQXSCSZQPS-UHFFFAOYSA-N Synonyme: benzoin methyl ether,methyl benzoin,benzoin methyl ester,o-methylbenzoin,2-methoxy-2-phenylacetophenone,nisso cure mbo,ethanone, 2-methoxy-1,2-diphenyl,acetophenone, 2-methoxy-2-phenyl,qcu 3,alpha-methoxydeoxybenzoin CID PubChem: 98097 Nom IUPAC: 2-methoxy-1,2-diphenylethanone SMILES: COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2

Poids moléculaire (g/mol) 226.275
Synonyme benzoin methyl ether,methyl benzoin,benzoin methyl ester,o-methylbenzoin,2-methoxy-2-phenylacetophenone,nisso cure mbo,ethanone, 2-methoxy-1,2-diphenyl,acetophenone, 2-methoxy-2-phenyl,qcu 3,alpha-methoxydeoxybenzoin
Numéro MDL MFCD00008492
CAS 3524-62-7
CID PubChem 98097
Nom IUPAC 2-methoxy-1,2-diphenylethanone
Clé InChI BQZJOQXSCSZQPS-UHFFFAOYSA-N
SMILES COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
Formule moléculaire C15H14O2
6

4,4'-Diaminostilbene-2,2'-disulfonic acid, 95%

CAS: 81-11-8 Formule moléculaire: C14H14N2O6S2 Poids moléculaire (g/mol): 370.4 Numéro MDL: MFCD00024946 Clé InChI: REJHVSOVQBJEBF-OWOJBTEDSA-N Synonyme: 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 CID PubChem: 5284378 Nom IUPAC: 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

Poids moléculaire (g/mol) 370.4
Synonyme 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
Numéro MDL MFCD00024946
CAS 81-11-8
CID PubChem 5284378
Nom IUPAC 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid
Clé InChI REJHVSOVQBJEBF-OWOJBTEDSA-N
SMILES C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O
Formule moléculaire C14H14N2O6S2
7

Anisoin, 95%

CAS: 119-52-8 Formule moléculaire: C16H16O4 Poids moléculaire (g/mol): 272.30 Numéro MDL: MFCD00008411 Clé InChI: LRRQSCPPOIUNGX-UHFFFAOYNA-N Synonyme: anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one CID PubChem: 95415 Nom IUPAC: 2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1

Poids moléculaire (g/mol) 272.30
Synonyme anisoin,2-hydroxy-1,2-bis 4-methoxyphenyl ethanone,4,4'-dimethoxybenzoin,p-anisoin,ethanone, 2-hydroxy-1,2-bis 4-methoxyphenyl,benzoin, 4,4'-dimethoxy,p,p'-dimethoxybenzoin,benzoin,4'-dimethoxy,4,4'-anisoin,1,2-bis 4-methoxyphenyl-2-hydroxyethan-1-one
Numéro MDL MFCD00008411
CAS 119-52-8
CID PubChem 95415
Nom IUPAC 2-hydroxy-1,2-bis(4-methoxyphenyl)ethanone
Clé InChI LRRQSCPPOIUNGX-UHFFFAOYNA-N
SMILES COC1=CC=C(C=C1)C(O)C(=O)C1=CC=C(OC)C=C1
Formule moléculaire C16H16O4
8

Chrysophenine sodium salt, Thermo Scientific Chemicals

CAS: 2870-32-8 Formule moléculaire: C30H26N4Na2O8S2 Poids moléculaire (g/mol): 680.66 Numéro MDL: MFCD00007488 Clé InChI: YQMJDPHTMKUEHG-RPKDOIGLSA-L Synonyme: chrysophenine g,chrysophenine j,chrysophenine y,aurophenine o,chrysophenine gp,chrysophenine ns,direct yellow c,benzo yellow lg,erie yellow y,chrysophenine esp CID PubChem: 54603156 Nom IUPAC: sodium;5-[(4-ethoxyphenyl)diazenyl]-2-[(E)-2-[4-[(4-ethoxyphenyl)diazenyl]-2-sulfophenyl]ethenyl]benzenesulfonic acid SMILES: [Na+].[Na+].CCOC1=CC=C(C=C1)N=NC1=CC=C(\C=C/C2=CC=C(C=C2S([O-])(=O)=O)N=NC2=CC=C(OCC)C=C2)C(=C1)S([O-])(=O)=O

Poids moléculaire (g/mol) 680.66
Synonyme chrysophenine g,chrysophenine j,chrysophenine y,aurophenine o,chrysophenine gp,chrysophenine ns,direct yellow c,benzo yellow lg,erie yellow y,chrysophenine esp
Numéro MDL MFCD00007488
CAS 2870-32-8
CID PubChem 54603156
Nom IUPAC sodium;5-[(4-ethoxyphenyl)diazenyl]-2-[(E)-2-[4-[(4-ethoxyphenyl)diazenyl]-2-sulfophenyl]ethenyl]benzenesulfonic acid
Clé InChI YQMJDPHTMKUEHG-RPKDOIGLSA-L
SMILES [Na+].[Na+].CCOC1=CC=C(C=C1)N=NC1=CC=C(\C=C/C2=CC=C(C=C2S([O-])(=O)=O)N=NC2=CC=C(OCC)C=C2)C(=C1)S([O-])(=O)=O
Formule moléculaire C30H26N4Na2O8S2
9

4-Amino-4'-nitrostilbene-2,2'-disulfonic acid, tech. 80%, Thermo Scientific Chemicals

CAS: 119-72-2 Formule moléculaire: C14H12N2O8S2 Poids moléculaire (g/mol): 400.376 Numéro MDL: MFCD00035915 Clé InChI: GHBWBMDGBCKAQU-OWOJBTEDSA-N Synonyme: 4-nitro-4'-aminostilbene-2,2'-disulfonic acid,4-amino-4'-nitro-2,2'-stilbenedisulfonic acid,4-amino-4'-nitrostilbene-2,2'-disulfonic acid,kyselina 4-amino-4'-nitrostilben-2,2'-disulfonova czech,kyselina 4-nitro-4'-aminostilben-2,2'-disulfonova czech,benzenesulfonic acid, 5-amino-2-2-4-nitro-2-sulfophenyl ethenyl,2,2'-stilbenedisulfonic acid, 4-amino-4'-nitro,5-amino-2-2-4-nitro-2-sulphophenyl vinyl benzenesulphonic acid,5-amino-2-e-2-4-nitro-2-sulfo-phenyl vinyl benzenesulfonic acid,5-amino-2-e-2-4-nitro-2-sulfophenyl ethenyl benzenesulfonic acid CID PubChem: 5473847 Nom IUPAC: 5-amino-2-[(E)-2-(4-nitro-2-sulfophenyl)ethenyl]benzenesulfonic acid SMILES: C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

Poids moléculaire (g/mol) 400.376
Synonyme 4-nitro-4'-aminostilbene-2,2'-disulfonic acid,4-amino-4'-nitro-2,2'-stilbenedisulfonic acid,4-amino-4'-nitrostilbene-2,2'-disulfonic acid,kyselina 4-amino-4'-nitrostilben-2,2'-disulfonova czech,kyselina 4-nitro-4'-aminostilben-2,2'-disulfonova czech,benzenesulfonic acid, 5-amino-2-2-4-nitro-2-sulfophenyl ethenyl,2,2'-stilbenedisulfonic acid, 4-amino-4'-nitro,5-amino-2-2-4-nitro-2-sulphophenyl vinyl benzenesulphonic acid,5-amino-2-e-2-4-nitro-2-sulfo-phenyl vinyl benzenesulfonic acid,5-amino-2-e-2-4-nitro-2-sulfophenyl ethenyl benzenesulfonic acid
Numéro MDL MFCD00035915
CAS 119-72-2
CID PubChem 5473847
Nom IUPAC 5-amino-2-[(E)-2-(4-nitro-2-sulfophenyl)ethenyl]benzenesulfonic acid
Clé InChI GHBWBMDGBCKAQU-OWOJBTEDSA-N
SMILES C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O
Formule moléculaire C14H12N2O8S2
10

6-Bromocoumarin-3-carboxylic acid, 97%

CAS: 2199-87-3 Formule moléculaire: C10H5BrO4 Poids moléculaire (g/mol): 269.05 Numéro MDL: MFCD00047640 Clé InChI: XFQHPAXNKDYMOX-UHFFFAOYSA-N Synonyme: 6-bromo-2-oxo-2h-chromene-3-carboxylic acid,6-bromocoumarin-3-carboxylic acid,acmc-20alzr,maybridge1_000837,6-bromo-3-carboxy-coumarin,6-bromo-coumarin-3-carboxylic acid,2-oxo-6-bromo-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylicacid,6-bromo-2-oxo,2h-1-benzopyran-3-carboxylicacid, 6-bromo-2-oxo CID PubChem: 694463 Nom IUPAC: 6-bromo-2-oxochromene-3-carboxylic acid SMILES: C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O

Poids moléculaire (g/mol) 269.05
Synonyme 6-bromo-2-oxo-2h-chromene-3-carboxylic acid,6-bromocoumarin-3-carboxylic acid,acmc-20alzr,maybridge1_000837,6-bromo-3-carboxy-coumarin,6-bromo-coumarin-3-carboxylic acid,2-oxo-6-bromo-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylicacid,6-bromo-2-oxo,2h-1-benzopyran-3-carboxylicacid, 6-bromo-2-oxo
Numéro MDL MFCD00047640
CAS 2199-87-3
CID PubChem 694463
Nom IUPAC 6-bromo-2-oxochromene-3-carboxylic acid
Clé InChI XFQHPAXNKDYMOX-UHFFFAOYSA-N
SMILES C1=CC2=C(C=C1Br)C=C(C(=O)O2)C(=O)O
Formule moléculaire C10H5BrO4
11

3-Acetylcoumarin, 98+%

CAS: 3949-36-8 Formule moléculaire: C11H8O3 Poids moléculaire (g/mol): 188.182 Numéro MDL: MFCD00006853 Clé InChI: CSPIFKKOBWYOEX-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 77553 Nom IUPAC: 3-acetylchromen-2-one SMILES: CC(=O)C1=CC2=CC=CC=C2OC1=O

Poids moléculaire (g/mol) 188.182
Synonyme 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
Numéro MDL MFCD00006853
CAS 3949-36-8
CID PubChem 77553
Nom IUPAC 3-acetylchromen-2-one
Clé InChI CSPIFKKOBWYOEX-UHFFFAOYSA-N
SMILES CC(=O)C1=CC2=CC=CC=C2OC1=O
Formule moléculaire C11H8O3
12

7,8-Dihydroxy-4-methylcoumarin, 97%

CAS: 2107-77-9 Formule moléculaire: C10H8O4 Poids moléculaire (g/mol): 192.17 Numéro MDL: MFCD00016972 Clé InChI: NWQBYMPNIJXFNQ-UHFFFAOYSA-N Synonyme: 7,8-dihydroxy-4-methylcoumarin,4-methyldaphnetin,7,8-dihydroxy-4-methyl-2h-chromen-2-one,4-methyldaphnetine,4-methyl-7,8-dihydroxycoumarin,2h-1-benzopyran-2-one, 7,8-dihydroxy-4-methyl,coumarin, 7,8-dihydroxy-4-methyl,7,8-dihydroxy-4-methyl-2h-1-benzopyran-2-one,7,8-dihydroxy-4-methyl-chromen-2-one,7,8-dihydroxy-4-methyl-2-benzopyrone CID PubChem: 5355836 SMILES: CC1=CC(=O)OC2=C(O)C(O)=CC=C12

Poids moléculaire (g/mol) 192.17
Synonyme 7,8-dihydroxy-4-methylcoumarin,4-methyldaphnetin,7,8-dihydroxy-4-methyl-2h-chromen-2-one,4-methyldaphnetine,4-methyl-7,8-dihydroxycoumarin,2h-1-benzopyran-2-one, 7,8-dihydroxy-4-methyl,coumarin, 7,8-dihydroxy-4-methyl,7,8-dihydroxy-4-methyl-2h-1-benzopyran-2-one,7,8-dihydroxy-4-methyl-chromen-2-one,7,8-dihydroxy-4-methyl-2-benzopyrone
Numéro MDL MFCD00016972
CAS 2107-77-9
CID PubChem 5355836
Clé InChI NWQBYMPNIJXFNQ-UHFFFAOYSA-N
SMILES CC1=CC(=O)OC2=C(O)C(O)=CC=C12
Formule moléculaire C10H8O4
13

7-Amino-4-(trifluoromethyl)coumarin, 97%

CAS: 53518-15-3 Formule moléculaire: C10H6F3NO2 Poids moléculaire (g/mol): 229.158 Numéro MDL: MFCD00006858 Clé InChI: JBNOVHJXQSHGRL-UHFFFAOYSA-N Synonyme: coumarin 151,7-amino-4-trifluoromethyl coumarin,7-amino-4-trifluoromethylcoumarin,7-amino-4-trifluoromethyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-trifluoromethyl,7-amino-4-trifluoromethyl chromen-2-one,7-amino-4-trifluoromethyl-2-benzopyrone,7-amino-4-trifluoromethyl-chromen-2-one,pubchem8665,maybridge1_007017 CID PubChem: 100641 ChEBI: CHEBI:51772 Nom IUPAC: 7-amino-4-(trifluoromethyl)chromen-2-one SMILES: C1=CC2=C(C=C1N)OC(=O)C=C2C(F)(F)F

Poids moléculaire (g/mol) 229.158
Synonyme coumarin 151,7-amino-4-trifluoromethyl coumarin,7-amino-4-trifluoromethylcoumarin,7-amino-4-trifluoromethyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-trifluoromethyl,7-amino-4-trifluoromethyl chromen-2-one,7-amino-4-trifluoromethyl-2-benzopyrone,7-amino-4-trifluoromethyl-chromen-2-one,pubchem8665,maybridge1_007017
Numéro MDL MFCD00006858
CAS 53518-15-3
CID PubChem 100641
ChEBI CHEBI:51772
Nom IUPAC 7-amino-4-(trifluoromethyl)chromen-2-one
Clé InChI JBNOVHJXQSHGRL-UHFFFAOYSA-N
SMILES C1=CC2=C(C=C1N)OC(=O)C=C2C(F)(F)F
Formule moléculaire C10H6F3NO2
14

3,3'-Carbonylbis(7-diethylaminocoumarin), 99%

CAS: 63226-13-1 Formule moléculaire: C27H28N2O5 Poids moléculaire (g/mol): 460.52 Numéro MDL: MFCD00050047 Clé InChI: SANIRTQDABNCHF-UHFFFAOYSA-N Synonyme: 3,3'-carbonylbis 7-diethylaminocoumarin,3,3'-carbonylbis 7-diethylamino-2h-chromen-2-one,2h-1-benzopyran-2-one, 3,3'-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxochromene-3-carbonyl chromen-2-one,7-diethylamino-3-7-diethylamino-2-oxochromen-3-yl carbonyl chromen-2-one,3,3'-carbonyl-bis-7-diethylaminocoumarin,2h-1-benzopyran-2-one, 3,3-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxo-2h-chromen-3-yl carbonyl-2h-ch romen-2-one CID PubChem: 113160 Nom IUPAC: 7-(diethylamino)-3-[7-(diethylamino)-2-oxochromene-3-carbonyl]chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)N(CC)CC)OC3=O

Poids moléculaire (g/mol) 460.52
Synonyme 3,3'-carbonylbis 7-diethylaminocoumarin,3,3'-carbonylbis 7-diethylamino-2h-chromen-2-one,2h-1-benzopyran-2-one, 3,3'-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxochromene-3-carbonyl chromen-2-one,7-diethylamino-3-7-diethylamino-2-oxochromen-3-yl carbonyl chromen-2-one,3,3'-carbonyl-bis-7-diethylaminocoumarin,2h-1-benzopyran-2-one, 3,3-carbonylbis 7-diethylamino,7-diethylamino-3-7-diethylamino-2-oxo-2h-chromen-3-yl carbonyl-2h-ch romen-2-one
Numéro MDL MFCD00050047
CAS 63226-13-1
CID PubChem 113160
Nom IUPAC 7-(diethylamino)-3-[7-(diethylamino)-2-oxochromene-3-carbonyl]chromen-2-one
Clé InChI SANIRTQDABNCHF-UHFFFAOYSA-N
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)N(CC)CC)OC3=O
Formule moléculaire C27H28N2O5
15

Thermo Scientific Chemicals 7-Hydroxy-4-methylcoumarin, 97%

CAS: 90-33-5 Formule moléculaire: C10H8O3 Poids moléculaire (g/mol): 176.17 Numéro MDL: MFCD00006866 Clé InChI: HSHNITRMYYLLCV-UHFFFAOYSA-N Synonyme: 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic CID PubChem: 5280567 ChEBI: CHEBI:17224 Nom IUPAC: 7-hydroxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

Poids moléculaire (g/mol) 176.17
Synonyme 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic
Numéro MDL MFCD00006866
CAS 90-33-5
CID PubChem 5280567
ChEBI CHEBI:17224
Nom IUPAC 7-hydroxy-4-methylchromen-2-one
Clé InChI HSHNITRMYYLLCV-UHFFFAOYSA-N
SMILES CC1=CC(=O)OC2=CC(O)=CC=C12
Formule moléculaire C10H8O3