Coumarins and derivatives

Aromatic organic compounds that contain a benzene ring with two adjacent hydrogen atoms replaced by a lactone-like chain, forming a second six-membered heterocycle that shares two carbons with the benzene ring with the formula: C9H6O2.

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61 – 75 of 573 results

7-(Diethylamino)coumarin-3-carboxylic Acid 98.0+%, TCI America™

CAS: 50995-74-9 Molecular Formula: C14H15NO4 Molecular Weight (g/mol): 261.277 MDL Number: MFCD00068721 InChI Key: WHCPTFFIERCDSB-UHFFFAOYSA-N PubChem CID: 659294 IUPAC Name: 7-(diethylamino)-2-oxochromene-3-carboxylic acid SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O

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PubChem CID	659294
CAS	50995-74-9
Molecular Weight (g/mol)	261.277
MDL Number	MFCD00068721
SMILES	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O
IUPAC Name	7-(diethylamino)-2-oxochromene-3-carboxylic acid
InChI Key	WHCPTFFIERCDSB-UHFFFAOYSA-N
Molecular Formula	C14H15NO4

3-(Bromoacetyl)coumarin 95.0+%, TCI America™

CAS: 29310-88-1 Molecular Formula: C11H7BrO3 Molecular Weight (g/mol): 267.08 MDL Number: MFCD00488331 InChI Key: NTYOLVNSXVYRTJ-UHFFFAOYSA-N Synonym: 3-bromoacetyl coumarin,3-2-bromoacetyl-2h-chromen-2-one,3-2-bromoacetyl chromen-2-one,3-bromoacetylcoumarin,3-bromoacetyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 3-bromoacetyl,pubchem8670,rarechem ab ka k003,3-2-bromoacetyl-coumarin PubChem CID: 2063461 IUPAC Name: 3-(2-bromoacetyl)-2H-chromen-2-one SMILES: BrCC(=O)C1=CC2=CC=CC=C2OC1=O

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PubChem CID	2063461
CAS	29310-88-1
Molecular Weight (g/mol)	267.08
MDL Number	MFCD00488331
SMILES	BrCC(=O)C1=CC2=CC=CC=C2OC1=O
Synonym	3-bromoacetyl coumarin,3-2-bromoacetyl-2h-chromen-2-one,3-2-bromoacetyl chromen-2-one,3-bromoacetylcoumarin,3-bromoacetyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 3-bromoacetyl,pubchem8670,rarechem ab ka k003,3-2-bromoacetyl-coumarin
IUPAC Name	3-(2-bromoacetyl)-2H-chromen-2-one
InChI Key	NTYOLVNSXVYRTJ-UHFFFAOYSA-N
Molecular Formula	C11H7BrO3

Coumarin 6H 97.0+%, TCI America™

CAS: 58336-35-9 Molecular Formula: C15H15NO2 Molecular Weight (g/mol): 241.29 MDL Number: MFCD00227485 InChI Key: MZSOXGPKUOAXNY-UHFFFAOYSA-N Synonym: 2,3,6,7-Tetrahydro-1H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11(5H)-one, 2,3,5,6-1H,4H-Tetrahydroquinolizino[9,9a,1-gh]coumarin PubChem CID: 94022 SMILES: C1CC2=C3C(=C4C(=C2)C=CC(=O)O4)CCCN3C1

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PubChem CID	94022
CAS	58336-35-9
Molecular Weight (g/mol)	241.29
MDL Number	MFCD00227485
SMILES	C1CC2=C3C(=C4C(=C2)C=CC(=O)O4)CCCN3C1
Synonym	2,3,6,7-Tetrahydro-1H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11(5H)-one, 2,3,5,6-1H,4H-Tetrahydroquinolizino[9,9a,1-gh]coumarin
InChI Key	MZSOXGPKUOAXNY-UHFFFAOYSA-N
Molecular Formula	C15H15NO2

Ethyl Coumarin-3-carboxylate 98.0+%, TCI America™

CAS: 1846-76-0 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.208 MDL Number: MFCD00016964 InChI Key: XKHPEMKBJGUYCM-UHFFFAOYSA-N Synonym: ethyl coumarin-3-carboxylate,ethyl 2-oxo-2h-chromene-3-carboxylate,3-ethoxycarbonylcoumarin,ethyl 3-coumarincarboxylate,3-carbethoxycoumarin,ethylcoumarin-3-carboxylate,coumarin-3-carboxylic acid ethyl ester,1,2-benzopyran-2-one-3-carboxylic acid, ethyl ester,2h-1-benzopyran-3-carboxylic acid, 2-oxo-, ethyl ester,2h-1-benzopyran-3-carboxylicacid, 2-oxo-, ethyl ester PubChem CID: 15800 IUPAC Name: ethyl 2-oxochromene-3-carboxylate SMILES: CCOC(=O)C1=CC2=CC=CC=C2OC1=O

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PubChem CID	15800
CAS	1846-76-0
Molecular Weight (g/mol)	218.208
MDL Number	MFCD00016964
SMILES	CCOC(=O)C1=CC2=CC=CC=C2OC1=O
Synonym	ethyl coumarin-3-carboxylate,ethyl 2-oxo-2h-chromene-3-carboxylate,3-ethoxycarbonylcoumarin,ethyl 3-coumarincarboxylate,3-carbethoxycoumarin,ethylcoumarin-3-carboxylate,coumarin-3-carboxylic acid ethyl ester,1,2-benzopyran-2-one-3-carboxylic acid, ethyl ester,2h-1-benzopyran-3-carboxylic acid, 2-oxo-, ethyl ester,2h-1-benzopyran-3-carboxylicacid, 2-oxo-, ethyl ester
IUPAC Name	ethyl 2-oxochromene-3-carboxylate
InChI Key	XKHPEMKBJGUYCM-UHFFFAOYSA-N
Molecular Formula	C12H10O4

Ethyl 6-Bromocoumarin-3-carboxylate 98.0+%, TCI America™

CAS: 2199-90-8 Molecular Formula: C12H9BrO4 Molecular Weight (g/mol): 297.104 MDL Number: MFCD00124584 InChI Key: RXGDNKCWEKUYQA-UHFFFAOYSA-N Synonym: 6-Bromocoumarin-3-carboxylic Acid Ethyl Ester PubChem CID: 691747 IUPAC Name: ethyl 6-bromo-2-oxochromene-3-carboxylate SMILES: CCOC(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O

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PubChem CID	691747
CAS	2199-90-8
Molecular Weight (g/mol)	297.104
MDL Number	MFCD00124584
SMILES	CCOC(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O
Synonym	6-Bromocoumarin-3-carboxylic Acid Ethyl Ester
IUPAC Name	ethyl 6-bromo-2-oxochromene-3-carboxylate
InChI Key	RXGDNKCWEKUYQA-UHFFFAOYSA-N
Molecular Formula	C12H9BrO4

6-Fluoro-4-hydroxycoumarin 98.0+%, TCI America™

CAS: 1994-13-4 Molecular Formula: C9H5FO3 Molecular Weight (g/mol): 180.13 MDL Number: MFCD03094006 InChI Key: JCOYNGQUPPGRNB-UHFFFAOYSA-N PubChem CID: 54691406 IUPAC Name: 6-fluoro-4-hydroxy-2H-chromen-2-one SMILES: OC1=CC(=O)OC2=CC=C(F)C=C12

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PubChem CID	54691406
CAS	1994-13-4
Molecular Weight (g/mol)	180.13
MDL Number	MFCD03094006
SMILES	OC1=CC(=O)OC2=CC=C(F)C=C12
IUPAC Name	6-fluoro-4-hydroxy-2H-chromen-2-one
InChI Key	JCOYNGQUPPGRNB-UHFFFAOYSA-N
Molecular Formula	C9H5FO3

4-Carboxymethyl-6,7-methylenedioxycoumarin 95.0+%, TCI America™

CAS: 97744-77-9 Molecular Formula: C12H8O6 Molecular Weight (g/mol): 248.19 MDL Number: MFCD00143278 InChI Key: PIHRLFGNZWHKIO-UHFFFAOYSA-N PubChem CID: 44630205 IUPAC Name: 2-{6-oxo-2H,6H-[1,3]dioxolo[4,5-g]chromen-8-yl}acetic acid SMILES: OC(=O)CC1=CC(=O)OC2=CC3=C(OCO3)C=C12

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PubChem CID	44630205
CAS	97744-77-9
Molecular Weight (g/mol)	248.19
MDL Number	MFCD00143278
SMILES	OC(=O)CC1=CC(=O)OC2=CC3=C(OCO3)C=C12
IUPAC Name	2-{6-oxo-2H,6H-[1,3]dioxolo[4,5-g]chromen-8-yl}acetic acid
InChI Key	PIHRLFGNZWHKIO-UHFFFAOYSA-N
Molecular Formula	C12H8O6

Coumarin-3-carboxylic Acid 98.0+%, TCI America™

CAS: 531-81-7 Molecular Formula: C10H6O4 Molecular Weight (g/mol): 190.154 MDL Number: MFCD00006852 InChI Key: ACMLKANOGIVEPB-UHFFFAOYSA-N Synonym: coumarin-3-carboxylic acid,2-oxo-2h-chromene-3-carboxylic acid,3-carboxycoumarin,2-oxobenzopyran-3-carboxylic acid,g 1 rodenticide,2h-1-benzopyran-3-carboxylic acid, 2-oxo,2-oxo-2h-1-benzopyran-3-carboxylic acid,unii-v85uov8788,g 1 the rodenticide van,g 1 van PubChem CID: 10752 IUPAC Name: 2-oxochromene-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)O

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PubChem CID	10752
CAS	531-81-7
Molecular Weight (g/mol)	190.154
MDL Number	MFCD00006852
SMILES	C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)O
Synonym	coumarin-3-carboxylic acid,2-oxo-2h-chromene-3-carboxylic acid,3-carboxycoumarin,2-oxobenzopyran-3-carboxylic acid,g 1 rodenticide,2h-1-benzopyran-3-carboxylic acid, 2-oxo,2-oxo-2h-1-benzopyran-3-carboxylic acid,unii-v85uov8788,g 1 the rodenticide van,g 1 van
IUPAC Name	2-oxochromene-3-carboxylic acid
InChI Key	ACMLKANOGIVEPB-UHFFFAOYSA-N
Molecular Formula	C10H6O4

Coumarin 478 98.0+%, TCI America™

CAS: 41175-45-5 Molecular Formula: C18H19NO2 Molecular Weight (g/mol): 281.355 MDL Number: MFCD00041949 InChI Key: LLSRPENMALNOFW-UHFFFAOYSA-N Synonym: coumarin 106,coumarin 478,2,3,6,7,10,11-hexahydro-1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one,1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro,3-oxa-16-azapentacyclo 10.7.1.0 2 , 1 ?.0?,?.0 1 ?, 2 ? icosa-1,5 9 ,10,12 20-tetraen-4-one,coumarin 107,1h,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro,1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro-9ci PubChem CID: 100336 SMILES: C1CC2=C(C1)C(=O)OC3=C4CCCN5C4=C(CCC5)C=C23

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PubChem CID	100336
CAS	41175-45-5
Molecular Weight (g/mol)	281.355
MDL Number	MFCD00041949
SMILES	C1CC2=C(C1)C(=O)OC3=C4CCCN5C4=C(CCC5)C=C23
Synonym	coumarin 106,coumarin 478,2,3,6,7,10,11-hexahydro-1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one,1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro,3-oxa-16-azapentacyclo 10.7.1.0 2 , 1 ?.0?,?.0 1 ?, 2 ? icosa-1,5 9 ,10,12 20-tetraen-4-one,coumarin 107,1h,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro,1h,5h-cyclopenta 3,4 1 benzopyrano 6,7,8-ij quinolizin-12 9h-one, 2,3,6,7,10,11-hexahydro-9ci
InChI Key	LLSRPENMALNOFW-UHFFFAOYSA-N
Molecular Formula	C18H19NO2

Coumarin 510 98.0+%, TCI America™

CAS: 87349-92-6 Molecular Formula: C20H18N2O2 Molecular Weight (g/mol): 318.376 MDL Number: MFCD00467042 InChI Key: OEEAIIVRKIVRNX-UHFFFAOYSA-N Synonym: 2,3,6,7-Tetrahydro-10-(3-pyridyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one PubChem CID: 9905078 SMILES: C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C5=CN=CC=C5)CCCN3C1

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PubChem CID	9905078
CAS	87349-92-6
Molecular Weight (g/mol)	318.376
MDL Number	MFCD00467042
SMILES	C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C5=CN=CC=C5)CCCN3C1
Synonym	2,3,6,7-Tetrahydro-10-(3-pyridyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
InChI Key	OEEAIIVRKIVRNX-UHFFFAOYSA-N
Molecular Formula	C20H18N2O2

7-(Diethylamino)coumarin 98.0+%, TCI America™

CAS: 20571-42-0 Molecular Formula: C13H15NO2 Molecular Weight (g/mol): 217.27 MDL Number: MFCD00232946 InChI Key: QXAMGWKESXGGNV-UHFFFAOYSA-N PubChem CID: 88598 IUPAC Name: 7-(diethylamino)-2H-chromen-2-one SMILES: CCN(CC)C1=CC=C2C=CC(=O)OC2=C1

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PubChem CID	88598
CAS	20571-42-0
Molecular Weight (g/mol)	217.27
MDL Number	MFCD00232946
SMILES	CCN(CC)C1=CC=C2C=CC(=O)OC2=C1
IUPAC Name	7-(diethylamino)-2H-chromen-2-one
InChI Key	QXAMGWKESXGGNV-UHFFFAOYSA-N
Molecular Formula	C13H15NO2

7-Hydroxy-4-(trifluoromethyl)coumarin 98.0+%, TCI America™

CAS: 575-03-1 Molecular Formula: C10H5F3O3 Molecular Weight (g/mol): 230.142 MDL Number: MFCD00037578 InChI Key: CCKWMCUOHJAVOL-UHFFFAOYSA-N Synonym: 7-hydroxy-4-trifluoromethyl coumarin,7-hydroxy-4-trifluoromethylcoumarin,7-hydroxy-4-trifluoromethyl-2h-chromen-2-one,7-hydroxy-4-trifluoromethyl chromen-2-one,4-trifluoromethyl umbelliferone,7-hydroxy-4-trifluoromethyl-chromen-2-one,2h-1-benzopyran-2-one, 7-hydroxy-4-trifluoromethyl,7,4-hfc,maybridge1_006885,tfmu PubChem CID: 5375667 IUPAC Name: 7-hydroxy-4-(trifluoromethyl)chromen-2-one SMILES: C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F

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PubChem CID	5375667
CAS	575-03-1
Molecular Weight (g/mol)	230.142
MDL Number	MFCD00037578
SMILES	C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F
Synonym	7-hydroxy-4-trifluoromethyl coumarin,7-hydroxy-4-trifluoromethylcoumarin,7-hydroxy-4-trifluoromethyl-2h-chromen-2-one,7-hydroxy-4-trifluoromethyl chromen-2-one,4-trifluoromethyl umbelliferone,7-hydroxy-4-trifluoromethyl-chromen-2-one,2h-1-benzopyran-2-one, 7-hydroxy-4-trifluoromethyl,7,4-hfc,maybridge1_006885,tfmu
IUPAC Name	7-hydroxy-4-(trifluoromethyl)chromen-2-one
InChI Key	CCKWMCUOHJAVOL-UHFFFAOYSA-N
Molecular Formula	C10H5F3O3

4-Hydroxy-6-methylcoumarin 98.0+%, TCI America™

CAS: 13252-83-0 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.17 MDL Number: MFCD00085738 InChI Key: CSVFZDYJGBVNEX-UHFFFAOYSA-N Synonym: 4-hydroxy-6-methylcoumarin,4-hydroxy-6-methyl-2h-chromen-2-one,6-methyl-4-hydroxycoumarin,2h-1-benzopyran-2-one,4-hydroxy-6-methyl,2h-1-benzopyran-2-one, 4-hydroxy-6-methyl,2-hydroxy-6-methylchromen-4-one,2-hydroxy-6-methyl-4h-chromen-4-one,6-methyl-4-hydroxy coumarin,hydroxy-6-methylcoumarin,4 PubChem CID: 54686349 IUPAC Name: 2-hydroxy-6-methyl-4H-chromen-4-one SMILES: CC1=CC=C2OC(O)=CC(=O)C2=C1

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PubChem CID	54686349
CAS	13252-83-0
Molecular Weight (g/mol)	176.17
MDL Number	MFCD00085738
SMILES	CC1=CC=C2OC(O)=CC(=O)C2=C1
Synonym	4-hydroxy-6-methylcoumarin,4-hydroxy-6-methyl-2h-chromen-2-one,6-methyl-4-hydroxycoumarin,2h-1-benzopyran-2-one,4-hydroxy-6-methyl,2h-1-benzopyran-2-one, 4-hydroxy-6-methyl,2-hydroxy-6-methylchromen-4-one,2-hydroxy-6-methyl-4h-chromen-4-one,6-methyl-4-hydroxy coumarin,hydroxy-6-methylcoumarin,4
IUPAC Name	2-hydroxy-6-methyl-4H-chromen-4-one
InChI Key	CSVFZDYJGBVNEX-UHFFFAOYSA-N
Molecular Formula	C10H8O3

4-Hydroxy-7-methoxycoumarin 98.0+%, TCI America™

CAS: 17575-15-4 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00673700 InChI Key: HFGKBQZAHZKDLV-UHFFFAOYSA-N Synonym: 4-hydroxy-7-methoxycoumarin,4-hydroxy-7-methoxy-2h-chromen-2-one,2-hydroxy-7-methoxy-4h-chromen-4-one,2-hydroxy-7-methoxychromen-4-one,4-hydroxy-7-methoxy-2h-1-benzopyran-2-one,4-hydroxy-7-met hoxycoumarin,4-hydroxy-7-methoxy-coumarin,4-hydroxy-7-methoxy-2-oxo-2h-chromene,2h-1-benzopyran-2-one,4-hydroxy-7-methoxy,2h-1-benzopyran-2-one, 4-hydroxy-7-methoxy PubChem CID: 54691408 IUPAC Name: 2-hydroxy-7-methoxy-4H-chromen-4-one SMILES: COC1=CC=C2C(=O)C=C(O)OC2=C1

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PubChem CID	54691408
CAS	17575-15-4
Molecular Weight (g/mol)	192.17
MDL Number	MFCD00673700
SMILES	COC1=CC=C2C(=O)C=C(O)OC2=C1
Synonym	4-hydroxy-7-methoxycoumarin,4-hydroxy-7-methoxy-2h-chromen-2-one,2-hydroxy-7-methoxy-4h-chromen-4-one,2-hydroxy-7-methoxychromen-4-one,4-hydroxy-7-methoxy-2h-1-benzopyran-2-one,4-hydroxy-7-met hoxycoumarin,4-hydroxy-7-methoxy-coumarin,4-hydroxy-7-methoxy-2-oxo-2h-chromene,2h-1-benzopyran-2-one,4-hydroxy-7-methoxy,2h-1-benzopyran-2-one, 4-hydroxy-7-methoxy
IUPAC Name	2-hydroxy-7-methoxy-4H-chromen-4-one
InChI Key	HFGKBQZAHZKDLV-UHFFFAOYSA-N
Molecular Formula	C10H8O4

4-Methylumbelliferyl Phosphate 98.0+%, TCI America™

CAS: 3368-04-5 Molecular Formula: C10H9O6P Molecular Weight (g/mol): 256.15 MDL Number: MFCD00016969 InChI Key: BCHIXGBGRHLSBE-UHFFFAOYSA-N Synonym: 4-methylumbelliferyl phosphate,4-methyl-2-oxo-2h-chromen-7-yl dihydrogen phosphate,4-mup,2h-1-benzopyran-2-one, 4-methyl-7-phosphonooxy,phosphoric acid 4-methylumbelliferyl ester,4-methylumbelliferylphosphate, free acid,4-methyl-2-oxochromen-7-yl oxyphosphonic acid,5,5-dinitrobarbutyric acid,4-methylumbelliferone phosphate,4-methylumbelliferyl phosphate, free acid PubChem CID: 65118 IUPAC Name: (4-methyl-2-oxochromen-7-yl) dihydrogen phosphate SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)(O)O

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PubChem CID	65118
CAS	3368-04-5
Molecular Weight (g/mol)	256.15
MDL Number	MFCD00016969
SMILES	CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)(O)O
Synonym	4-methylumbelliferyl phosphate,4-methyl-2-oxo-2h-chromen-7-yl dihydrogen phosphate,4-mup,2h-1-benzopyran-2-one, 4-methyl-7-phosphonooxy,phosphoric acid 4-methylumbelliferyl ester,4-methylumbelliferylphosphate, free acid,4-methyl-2-oxochromen-7-yl oxyphosphonic acid,5,5-dinitrobarbutyric acid,4-methylumbelliferone phosphate,4-methylumbelliferyl phosphate, free acid
IUPAC Name	(4-methyl-2-oxochromen-7-yl) dihydrogen phosphate
InChI Key	BCHIXGBGRHLSBE-UHFFFAOYSA-N
Molecular Formula	C10H9O6P

Coumarins and derivatives

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