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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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Keyword Search:
91 – 105 of 573 results
91

Coumarin 99.0+%, TCI America™

CAS: 91-64-5 Molecular Formula: C9H6O2 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00006850 InChI Key: ZYGHJZDHTFUPRJ-UHFFFAOYSA-N Synonym: coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone PubChem CID: 323 ChEBI: CHEBI:28794 IUPAC Name: 2H-chromen-2-one SMILES: O=C1OC2=CC=CC=C2C=C1

PubChem CID 323
CAS 91-64-5
Molecular Weight (g/mol) 146.15
ChEBI CHEBI:28794
MDL Number MFCD00006850
SMILES O=C1OC2=CC=CC=C2C=C1
Synonym coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone
IUPAC Name 2H-chromen-2-one
InChI Key ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Molecular Formula C9H6O2
92

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

CAS: 54711-38-5 Molecular Formula: C14H17NO3 Molecular Weight (g/mol): 247.294 MDL Number: MFCD03424352 InChI Key: NMZSXNOCNJMJQT-UHFFFAOYSA-N PubChem CID: 14532761 IUPAC Name: 7-(diethylamino)-4-(hydroxymethyl)chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)CO

PubChem CID 14532761
CAS 54711-38-5
Molecular Weight (g/mol) 247.294
MDL Number MFCD03424352
SMILES CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)CO
IUPAC Name 7-(diethylamino)-4-(hydroxymethyl)chromen-2-one
InChI Key NMZSXNOCNJMJQT-UHFFFAOYSA-N
Molecular Formula C14H17NO3
93

Ethyl 7-(Diethylamino)coumarin-3-carboxylate 98.0+%, TCI America™

CAS: 28705-46-6 Molecular Formula: C16H19NO4 Molecular Weight (g/mol): 289.331 MDL Number: MFCD00227484 InChI Key: MSOLGAJLRIINNF-UHFFFAOYSA-N Synonym: 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester PubChem CID: 120014 IUPAC Name: ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC

PubChem CID 120014
CAS 28705-46-6
Molecular Weight (g/mol) 289.331
MDL Number MFCD00227484
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC
Synonym 7-(Diethylamino)coumarin-3-carboxylic Acid Ethyl Ester
IUPAC Name ethyl 7-(diethylamino)-2-oxochromene-3-carboxylate
InChI Key MSOLGAJLRIINNF-UHFFFAOYSA-N
Molecular Formula C16H19NO4
94

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

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
95

7-Amino-4-methylcoumarin 98.0+%, TCI America™

CAS: 26093-31-2 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00006868 InChI Key: GLNDAGDHSLMOKX-UHFFFAOYSA-N Synonym: 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x PubChem CID: 92249 ChEBI: CHEBI:51771 IUPAC Name: 7-amino-4-methyl-2H-chromen-2-one SMILES: CC1=CC(=O)OC2=CC(N)=CC=C12

PubChem CID 92249
CAS 26093-31-2
Molecular Weight (g/mol) 175.19
ChEBI CHEBI:51771
MDL Number MFCD00006868
SMILES CC1=CC(=O)OC2=CC(N)=CC=C12
Synonym 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x
IUPAC Name 7-amino-4-methyl-2H-chromen-2-one
InChI Key GLNDAGDHSLMOKX-UHFFFAOYSA-N
Molecular Formula C10H9NO2
96

Coumarin 521T 98.0+%, TCI America™

CAS: 114768-72-8 Molecular Formula: C21H25NO3 Molecular Weight (g/mol): 339.435 InChI Key: NGTDVJOJDMQAMI-UHFFFAOYSA-N Synonym: 10-Acetyl-2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one PubChem CID: 14365279 SMILES: CC(=O)C1=CC2=CC3=C4C(=C2OC1=O)C(CCN4CCC3(C)C)(C)C

PubChem CID 14365279
CAS 114768-72-8
Molecular Weight (g/mol) 339.435
SMILES CC(=O)C1=CC2=CC3=C4C(=C2OC1=O)C(CCN4CCC3(C)C)(C)C
Synonym 10-Acetyl-2,3,6,7-tetrahydro-1,1,7,7-tetramethyl-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-one
InChI Key NGTDVJOJDMQAMI-UHFFFAOYSA-N
Molecular Formula C21H25NO3
97

4-Methylesculetin 98.0+%, TCI America™

CAS: 529-84-0 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00006859 InChI Key: KVOJTUXGYQVLAJ-UHFFFAOYSA-N Synonym: 4-methylesculetin,6,7-dihydroxy-4-methylcoumarin,methylesculetin,6,7-dihydroxy-4-methyl-2h-chromen-2-one,4-methylaesculetin,4-methylesculetol,4-methyl-6,7-dihydroxycoumarin,2h-1-benzopyran-2-one, 6,7-dihydroxy-4-methyl,coumarin, 6,7-dihydroxy-4-methyl,6,7-dihydroxy-4-methyl-2h-benzopyran-2-one PubChem CID: 5319502 IUPAC Name: 6,7-dihydroxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(=C(C=C12)O)O

PubChem CID 5319502
CAS 529-84-0
Molecular Weight (g/mol) 192.17
MDL Number MFCD00006859
SMILES CC1=CC(=O)OC2=CC(=C(C=C12)O)O
Synonym 4-methylesculetin,6,7-dihydroxy-4-methylcoumarin,methylesculetin,6,7-dihydroxy-4-methyl-2h-chromen-2-one,4-methylaesculetin,4-methylesculetol,4-methyl-6,7-dihydroxycoumarin,2h-1-benzopyran-2-one, 6,7-dihydroxy-4-methyl,coumarin, 6,7-dihydroxy-4-methyl,6,7-dihydroxy-4-methyl-2h-benzopyran-2-one
IUPAC Name 6,7-dihydroxy-4-methylchromen-2-one
InChI Key KVOJTUXGYQVLAJ-UHFFFAOYSA-N
Molecular Formula C10H8O4
98

7-Methylcoumarin 98.0+%, TCI America™

CAS: 2445-83-2 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00006880 InChI Key: DLHXRDUXNVEIEY-UHFFFAOYSA-N Synonym: 7-methylcoumarin,2h-1-benzopyran-2-one, 7-methyl,7-methyl-2h-chromen-2-one,coumarin, 7-methyl,7-methyl coumarin,7-methylcumarin,7-methyl-2h-1-benzopyran-2-one,unii-ycn83t03qu,7-methyl-coumarin,7-methyl-chromen-2-one PubChem CID: 17131 IUPAC Name: 7-methyl-2H-chromen-2-one SMILES: CC1=CC=C2C=CC(=O)OC2=C1

PubChem CID 17131
CAS 2445-83-2
Molecular Weight (g/mol) 160.17
MDL Number MFCD00006880
SMILES CC1=CC=C2C=CC(=O)OC2=C1
Synonym 7-methylcoumarin,2h-1-benzopyran-2-one, 7-methyl,7-methyl-2h-chromen-2-one,coumarin, 7-methyl,7-methyl coumarin,7-methylcumarin,7-methyl-2h-1-benzopyran-2-one,unii-ycn83t03qu,7-methyl-coumarin,7-methyl-chromen-2-one
IUPAC Name 7-methyl-2H-chromen-2-one
InChI Key DLHXRDUXNVEIEY-UHFFFAOYSA-N
Molecular Formula C10H8O2
99

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

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
100

7-Ethoxy-4-methylcoumarin 97.0+%, TCI America™

CAS: 87-05-8 Molecular Formula: C12H12O3 Molecular Weight (g/mol): 204.23 MDL Number: MFCD00016971 InChI Key: NKRISXMDKXBVRJ-UHFFFAOYSA-N Synonym: 7-ethoxy-4-methylcoumarin,7-ethoxy-4-methyl-2h-chromen-2-one,4-methyl-7-ethoxycoumarin,2h-1-benzopyran-2-one, 7-ethoxy-4-methyl,unii-zlv1s0nnzh,coumarin, 7-ethoxy-4-methyl,zlv1s0nnzh,7-ethoxy-4-methyl-chromen-2-one,coumarin, 7-ethoxy-4-methyl-8ci,7-ethoxy-4-methyl-2h-1-benzopyran-2-one PubChem CID: 66595 IUPAC Name: 7-ethoxy-4-methyl-2H-chromen-2-one SMILES: CCOC1=CC=C2C(C)=CC(=O)OC2=C1

PubChem CID 66595
CAS 87-05-8
Molecular Weight (g/mol) 204.23
MDL Number MFCD00016971
SMILES CCOC1=CC=C2C(C)=CC(=O)OC2=C1
Synonym 7-ethoxy-4-methylcoumarin,7-ethoxy-4-methyl-2h-chromen-2-one,4-methyl-7-ethoxycoumarin,2h-1-benzopyran-2-one, 7-ethoxy-4-methyl,unii-zlv1s0nnzh,coumarin, 7-ethoxy-4-methyl,zlv1s0nnzh,7-ethoxy-4-methyl-chromen-2-one,coumarin, 7-ethoxy-4-methyl-8ci,7-ethoxy-4-methyl-2h-1-benzopyran-2-one
IUPAC Name 7-ethoxy-4-methyl-2H-chromen-2-one
InChI Key NKRISXMDKXBVRJ-UHFFFAOYSA-N
Molecular Formula C12H12O3
101

7-(Diethylamino)-3-(1-methyl-2-benzimidazolyl)coumarin 98.0+%, TCI America™

CAS: 41044-12-6 Molecular Formula: C21H21N3O2 Molecular Weight (g/mol): 347.418 MDL Number: MFCD00051349 InChI Key: KZFUMWVJJNDGAU-UHFFFAOYSA-N Synonym: coumarin 30,7-diethylamino-3-1-methyl-1h-benzo d imidazol-2-yl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl,ccris 4959,7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl-2h-chromen-2-one,3-2-n-methylbenzimidazolyl-7-n,n-diethylaminocoumarin,7-diethylamino-3-1-methylbenzimidazol-2-yl chromen-2-one,7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl-2-benzopyrone,7-diethylamino-3-1-methyl-1,3-benzodiazol-2-yl chromen-2-one,coumarin 515 PubChem CID: 100335 IUPAC Name: 7-(diethylamino)-3-(1-methylbenzimidazol-2-yl)chromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4N3C

PubChem CID 100335
CAS 41044-12-6
Molecular Weight (g/mol) 347.418
MDL Number MFCD00051349
SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4N3C
Synonym coumarin 30,7-diethylamino-3-1-methyl-1h-benzo d imidazol-2-yl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl,ccris 4959,7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl-2h-chromen-2-one,3-2-n-methylbenzimidazolyl-7-n,n-diethylaminocoumarin,7-diethylamino-3-1-methylbenzimidazol-2-yl chromen-2-one,7-diethylamino-3-1-methyl-1h-benzimidazol-2-yl-2-benzopyrone,7-diethylamino-3-1-methyl-1,3-benzodiazol-2-yl chromen-2-one,coumarin 515
IUPAC Name 7-(diethylamino)-3-(1-methylbenzimidazol-2-yl)chromen-2-one
InChI Key KZFUMWVJJNDGAU-UHFFFAOYSA-N
Molecular Formula C21H21N3O2
102

7-Ethoxycoumarin 97.0+%, TCI America™

CAS: 31005-02-4 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00006877 InChI Key: LIFAQMGORKPVDH-UHFFFAOYSA-N Synonym: 7-ethoxycoumarin,7-ethoxy-2h-chromen-2-one,ethylumbelliferone,2h-1-benzopyran-2-one, 7-ethoxy,7-ethoxy-2h-1-benzopyran-2-one,7-ethoxycoumarine,pubchem8680,coumarin, 7-ethoxy,acmc-209hjx PubChem CID: 35703 ChEBI: CHEBI:28184 IUPAC Name: 7-ethoxychromen-2-one SMILES: CCOC1=CC2=C(C=C1)C=CC(=O)O2

PubChem CID 35703
CAS 31005-02-4
Molecular Weight (g/mol) 190.198
ChEBI CHEBI:28184
MDL Number MFCD00006877
SMILES CCOC1=CC2=C(C=C1)C=CC(=O)O2
Synonym 7-ethoxycoumarin,7-ethoxy-2h-chromen-2-one,ethylumbelliferone,2h-1-benzopyran-2-one, 7-ethoxy,7-ethoxy-2h-1-benzopyran-2-one,7-ethoxycoumarine,pubchem8680,coumarin, 7-ethoxy,acmc-209hjx
IUPAC Name 7-ethoxychromen-2-one
InChI Key LIFAQMGORKPVDH-UHFFFAOYSA-N
Molecular Formula C11H10O3
103

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

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
104

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

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
105

6,7-Methylenedioxy-4-methyl-3-maleimidocoumarin 98.0+%, TCI America™

CAS: 97744-90-6 Molecular Formula: C15H9NO6 Molecular Weight (g/mol): 299.238 MDL Number: MFCD00059921 InChI Key: NSFINZUKLACTRX-UHFFFAOYSA-N Synonym: 3-Maleimido-4-methyl-6,7-methylenedioxycoumarin PubChem CID: 44630383 IUPAC Name: 1-(8-methyl-6-oxo-[1,3]dioxolo[4,5-g]chromen-7-yl)pyrrole-2,5-dione SMILES: CC1=C(C(=O)OC2=CC3=C(C=C12)OCO3)N4C(=O)C=CC4=O

PubChem CID 44630383
CAS 97744-90-6
Molecular Weight (g/mol) 299.238
MDL Number MFCD00059921
SMILES CC1=C(C(=O)OC2=CC3=C(C=C12)OCO3)N4C(=O)C=CC4=O
Synonym 3-Maleimido-4-methyl-6,7-methylenedioxycoumarin
IUPAC Name 1-(8-methyl-6-oxo-[1,3]dioxolo[4,5-g]chromen-7-yl)pyrrole-2,5-dione
InChI Key NSFINZUKLACTRX-UHFFFAOYSA-N
Molecular Formula C15H9NO6