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.

121 – 135 of 533 results

121

Coumarin 525 97.0+%, TCI America™

CAS: 87331-47-3 Molecular Formula: C22H18N2O3 Molecular Weight (g/mol): 358.397 InChI Key: XYFLALJXCJWBPG-UHFFFAOYSA-N Synonym: 10-(2-Benzoxazolyl)-2,3,6,7-tetrahydro-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one PubChem CID: 1371421 SMILES: C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C5=NC6=CC=CC=C6O5)CCCN3C1

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PubChem CID	1371421
CAS	87331-47-3
Molecular Weight (g/mol)	358.397
SMILES	C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C5=NC6=CC=CC=C6O5)CCCN3C1
Synonym	10-(2-Benzoxazolyl)-2,3,6,7-tetrahydro-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
InChI Key	XYFLALJXCJWBPG-UHFFFAOYSA-N
Molecular Formula	C22H18N2O3

122

7-(Ethylamino)-4-methylcoumarin 98.0+%, TCI America™

CAS: 28821-18-3 Molecular Formula: C12H13NO2 Molecular Weight (g/mol): 203.241 MDL Number: MFCD00467040 InChI Key: OTNIKUTWXUODJZ-UHFFFAOYSA-N Synonym: Coumarin 445 PubChem CID: 120061 IUPAC Name: 7-(ethylamino)-4-methylchromen-2-one SMILES: CCNC1=CC2=C(C=C1)C(=CC(=O)O2)C

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Specifications

PubChem CID	120061
CAS	28821-18-3
Molecular Weight (g/mol)	203.241
MDL Number	MFCD00467040
SMILES	CCNC1=CC2=C(C=C1)C(=CC(=O)O2)C
Synonym	Coumarin 445
IUPAC Name	7-(ethylamino)-4-methylchromen-2-one
InChI Key	OTNIKUTWXUODJZ-UHFFFAOYSA-N
Molecular Formula	C12H13NO2

123

Scopoletin 98.0+%, TCI America™

CAS: 92-61-5 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00006872 InChI Key: RODXRVNMMDRFIK-UHFFFAOYSA-N Synonym: scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin PubChem CID: 5280460 ChEBI: CHEBI:17488 IUPAC Name: 7-hydroxy-6-methoxychromen-2-one SMILES: COC1=C(C=C2C(=C1)C=CC(=O)O2)O

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Specifications

PubChem CID	5280460
CAS	92-61-5
Molecular Weight (g/mol)	192.17
ChEBI	CHEBI:17488
MDL Number	MFCD00006872
SMILES	COC1=C(C=C2C(=C1)C=CC(=O)O2)O
Synonym	scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin
IUPAC Name	7-hydroxy-6-methoxychromen-2-one
InChI Key	RODXRVNMMDRFIK-UHFFFAOYSA-N
Molecular Formula	C10H8O4

124

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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Specifications

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

125

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

CAS: 41934-47-8 Molecular Formula: C14H14F3NO2 Molecular Weight (g/mol): 285.266 MDL Number: MFCD00057313 InChI Key: UIMOXRDVWDLOHW-UHFFFAOYSA-N Synonym: Coumarin 481 PubChem CID: 94523 ChEBI: CHEBI:51777 IUPAC Name: 7-(diethylamino)-4-(trifluoromethyl)chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

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Specifications

PubChem CID	94523
CAS	41934-47-8
Molecular Weight (g/mol)	285.266
ChEBI	CHEBI:51777
MDL Number	MFCD00057313
SMILES	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F
Synonym	Coumarin 481
IUPAC Name	7-(diethylamino)-4-(trifluoromethyl)chromen-2-one
InChI Key	UIMOXRDVWDLOHW-UHFFFAOYSA-N
Molecular Formula	C14H14F3NO2

126

4-Methylcoumarin 98.0+%, TCI America™

CAS: 607-71-6 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.172 MDL Number: MFCD00185474 InChI Key: PSGQCCSGKGJLRL-UHFFFAOYSA-N PubChem CID: 11833 IUPAC Name: 4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC=CC=C12

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PubChem CID	11833
CAS	607-71-6
Molecular Weight (g/mol)	160.172
MDL Number	MFCD00185474
SMILES	CC1=CC(=O)OC2=CC=CC=C12
IUPAC Name	4-methylchromen-2-one
InChI Key	PSGQCCSGKGJLRL-UHFFFAOYSA-N
Molecular Formula	C10H8O2

127

3-Chlorocoumarin 98.0+%, TCI America™

CAS: 92-45-5 Molecular Formula: C9H5ClO2 Molecular Weight (g/mol): 180.59 MDL Number: MFCD00024073 InChI Key: CKCOPMSBJBNBCQ-UHFFFAOYSA-N Synonym: 3-chlorocoumarin,coumarin, 3-chloro,2h-1-benzopyran-2-one, 3-chloro,3-chloro-2h-chromen-2-one,chlorocoumarin,3-chloro-2h-1-benzopyran-2-one,acmc-1ciat,2h-1-benzopyran-2-one,3-chloro PubChem CID: 96133 IUPAC Name: 3-chloro-2H-chromen-2-one SMILES: ClC1=CC2=CC=CC=C2OC1=O

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Specifications

PubChem CID	96133
CAS	92-45-5
Molecular Weight (g/mol)	180.59
MDL Number	MFCD00024073
SMILES	ClC1=CC2=CC=CC=C2OC1=O
Synonym	3-chlorocoumarin,coumarin, 3-chloro,2h-1-benzopyran-2-one, 3-chloro,3-chloro-2h-chromen-2-one,chlorocoumarin,3-chloro-2h-1-benzopyran-2-one,acmc-1ciat,2h-1-benzopyran-2-one,3-chloro
IUPAC Name	3-chloro-2H-chromen-2-one
InChI Key	CKCOPMSBJBNBCQ-UHFFFAOYSA-N
Molecular Formula	C9H5ClO2

128

Coumarin 498 98.0+%, TCI America™

CAS: 87331-48-4 Molecular Formula: C16H17NO4S Molecular Weight (g/mol): 319.38 MDL Number: MFCD00467041 InChI Key: DPJWIXMOCGJKDG-UHFFFAOYSA-N Synonym: 2,3,6,7-Tetrahydro-10-(methylsulfonyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one PubChem CID: 91972096 IUPAC Name: 5-methanesulfonyl-3-oxa-13-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,5,7,9(17)-tetraen-4-one SMILES: CS(=O)(=O)C1=CC2=CC3=C4N(CCC3)CCCC4=C2OC1=O

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Specifications

PubChem CID	91972096
CAS	87331-48-4
Molecular Weight (g/mol)	319.38
MDL Number	MFCD00467041
SMILES	CS(=O)(=O)C1=CC2=CC3=C4N(CCC3)CCCC4=C2OC1=O
Synonym	2,3,6,7-Tetrahydro-10-(methylsulfonyl)-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
IUPAC Name	5-methanesulfonyl-3-oxa-13-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,5,7,9(17)-tetraen-4-one
InChI Key	DPJWIXMOCGJKDG-UHFFFAOYSA-N
Molecular Formula	C16H17NO4S

129

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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Specifications

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

130

7,8-Dihydroxy-4-methylcoumarin 98.0+%, TCI America™

CAS: 2107-77-9 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00016972 InChI Key: NWQBYMPNIJXFNQ-UHFFFAOYSA-N Synonym: 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 PubChem CID: 5355836 IUPAC Name: 7,8-dihydroxy-4-methyl-2H-chromen-2-one SMILES: CC1=CC(=O)OC2=C(O)C(O)=CC=C12

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Specifications

PubChem CID	5355836
CAS	2107-77-9
Molecular Weight (g/mol)	192.17
MDL Number	MFCD00016972
SMILES	CC1=CC(=O)OC2=C(O)C(O)=CC=C12
Synonym	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
IUPAC Name	7,8-dihydroxy-4-methyl-2H-chromen-2-one
InChI Key	NWQBYMPNIJXFNQ-UHFFFAOYSA-N
Molecular Formula	C10H8O4

131

7-Methoxycoumarin-3-carboxylic Acid 98.0+%, TCI America™

CAS: 20300-59-8 Molecular Formula: C11H8O5 Molecular Weight (g/mol): 220.18 MDL Number: MFCD00452770 InChI Key: VEEGNDSSWAOLFN-UHFFFAOYSA-N PubChem CID: 583941 IUPAC Name: 7-methoxy-2-oxo-2H-chromene-3-carboxylic acid SMILES: COC1=CC=C2C=C(C(O)=O)C(=O)OC2=C1

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Specifications

PubChem CID	583941
CAS	20300-59-8
Molecular Weight (g/mol)	220.18
MDL Number	MFCD00452770
SMILES	COC1=CC=C2C=C(C(O)=O)C(=O)OC2=C1
IUPAC Name	7-methoxy-2-oxo-2H-chromene-3-carboxylic acid
InChI Key	VEEGNDSSWAOLFN-UHFFFAOYSA-N
Molecular Formula	C11H8O5

132

Daphnetin 90.0+%, TCI America™

CAS: 486-35-1 Molecular Formula: C9H6O4 Molecular Weight (g/mol): 178.143 MDL Number: MFCD00016977 InChI Key: ATEFPOUAMCWAQS-UHFFFAOYSA-N Synonym: 7,8-Dihydroxycoumarin PubChem CID: 5280569 ChEBI: CHEBI:17313 IUPAC Name: 7,8-dihydroxychromen-2-one SMILES: C1=CC(=C(C2=C1C=CC(=O)O2)O)O

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PubChem CID	5280569
CAS	486-35-1
Molecular Weight (g/mol)	178.143
ChEBI	CHEBI:17313
MDL Number	MFCD00016977
SMILES	C1=CC(=C(C2=C1C=CC(=O)O2)O)O
Synonym	7,8-Dihydroxycoumarin
IUPAC Name	7,8-dihydroxychromen-2-one
InChI Key	ATEFPOUAMCWAQS-UHFFFAOYSA-N
Molecular Formula	C9H6O4

133

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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Specifications

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

134

Coumarin 102 97.0+%, TCI America™

CAS: 41267-76-9 Molecular Formula: C16H17NO2 Molecular Weight (g/mol): 255.317 MDL Number: MFCD00041844 InChI Key: XHXMPURWMSJENN-UHFFFAOYSA-N Synonym: coumarin 102,coumarin 480,exciton 480,ccris 4960,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizin-11-one, 2,3,6,7-tetrahydro-9-methyl,2,3,5,6-1h,4h-tetrahydro-8-methylquinolazino-9,9a,1-gh coumarin,2,3,6,7-tetrahydro-9-methyl-1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizin-11-one,9-methyl-2,3,6,7-tetrahydro-1h,5h,11h-pyrano 2,3-f pyrido 3,2,1-ij quinolin-11-one PubChem CID: 94517 ChEBI: CHEBI:51774 SMILES: CC1=CC(=O)OC2=C3CCCN4C3=C(CCC4)C=C12

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Specifications

PubChem CID	94517
CAS	41267-76-9
Molecular Weight (g/mol)	255.317
ChEBI	CHEBI:51774
MDL Number	MFCD00041844
SMILES	CC1=CC(=O)OC2=C3CCCN4C3=C(CCC4)C=C12
Synonym	coumarin 102,coumarin 480,exciton 480,ccris 4960,1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizin-11-one, 2,3,6,7-tetrahydro-9-methyl,2,3,5,6-1h,4h-tetrahydro-8-methylquinolazino-9,9a,1-gh coumarin,2,3,6,7-tetrahydro-9-methyl-1h,5h,11h-1 benzopyrano 6,7,8-ij quinolizin-11-one,9-methyl-2,3,6,7-tetrahydro-1h,5h,11h-pyrano 2,3-f pyrido 3,2,1-ij quinolin-11-one
InChI Key	XHXMPURWMSJENN-UHFFFAOYSA-N
Molecular Formula	C16H17NO2

135

7-Ethynylcoumarin 98.0+%, TCI America™

CAS: 270088-04-5 Molecular Formula: C11H6O2 Molecular Weight (g/mol): 170.17 MDL Number: MFCD28668960 InChI Key: NGKXZMHLZMPKFE-UHFFFAOYSA-N PubChem CID: 54110018 IUPAC Name: 7-ethynyl-2H-chromen-2-one SMILES: O=C1OC2=CC(=CC=C2C=C1)C#C

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Specifications

PubChem CID	54110018
CAS	270088-04-5
Molecular Weight (g/mol)	170.17
MDL Number	MFCD28668960
SMILES	O=C1OC2=CC(=CC=C2C=C1)C#C
IUPAC Name	7-ethynyl-2H-chromen-2-one
InChI Key	NGKXZMHLZMPKFE-UHFFFAOYSA-N
Molecular Formula	C11H6O2

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Coumarins and derivatives

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Coumarin 525 97.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7-(Ethylamino)-4-methylcoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Scopoletin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7-(Diethylamino)coumarin-3-carboxylic Acid 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7-(Diethylamino)-4-(trifluoromethyl)coumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

4-Methylcoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

3-Chlorocoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Coumarin 498 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

4-Hydroxy-6-methylcoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7,8-Dihydroxy-4-methylcoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7-Methoxycoumarin-3-carboxylic Acid 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Daphnetin 90.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Ethyl 6-Bromocoumarin-3-carboxylate 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Coumarin 102 97.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

7-Ethynylcoumarin 98.0+%, TCI America™ Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More