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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121 – 135 of 573 results

121

8-Methoxy-4-methylbenzo[g]coumarin 98.0+%, TCI America™

CAS: 69169-71-7 Molecular Formula: C15H12O3 Molecular Weight (g/mol): 240.26 MDL Number: MFCD00445784 InChI Key: GWFUYESISQUIHB-UHFFFAOYSA-N Synonym: 8-Methoxy-4-methyl-2H-naphtho[2,3-b]pyran-2-one PubChem CID: 12448345 IUPAC Name: 8-methoxy-4-methyl-2H-benzo[g]chromen-2-one SMILES: COC1=CC=C2C=C3C(C)=CC(=O)OC3=CC2=C1

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PubChem CID	12448345
CAS	69169-71-7
Molecular Weight (g/mol)	240.26
MDL Number	MFCD00445784
SMILES	COC1=CC=C2C=C3C(C)=CC(=O)OC3=CC2=C1
Synonym	8-Methoxy-4-methyl-2H-naphtho[2,3-b]pyran-2-one
IUPAC Name	8-methoxy-4-methyl-2H-benzo[g]chromen-2-one
InChI Key	GWFUYESISQUIHB-UHFFFAOYSA-N
Molecular Formula	C15H12O3

122

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

CAS: 4139-61-1 Molecular Formula: C9H5BrO3 Molecular Weight (g/mol): 241.04 MDL Number: MFCD00239372 InChI Key: KNMCTCABMSGXGR-UHFFFAOYSA-N PubChem CID: 54691404 IUPAC Name: 6-bromo-4-hydroxychromen-2-one SMILES: C1=CC2=C(C=C1Br)C(=CC(=O)O2)O

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Specifications

PubChem CID	54691404
CAS	4139-61-1
Molecular Weight (g/mol)	241.04
MDL Number	MFCD00239372
SMILES	C1=CC2=C(C=C1Br)C(=CC(=O)O2)O
IUPAC Name	6-bromo-4-hydroxychromen-2-one
InChI Key	KNMCTCABMSGXGR-UHFFFAOYSA-N
Molecular Formula	C9H5BrO3

123

4-Hydroxy-3-nitrocoumarin 98.0+%, TCI America™

CAS: 20261-31-8 Molecular Formula: C9H5NO5 Molecular Weight (g/mol): 207.141 MDL Number: MFCD00051671 InChI Key: NZQAQAUWFHMVEM-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrocoumarin,4-hydroxy-3-nitro-2h-chromen-2-one,3-nitro-4-hydroxycoumarin,2h-1-benzopyran-2-one, 4-hydroxy-3-nitro,2-hydroxy-3-nitrochromen-4-one,4-hydroxy-3-nitro-chromen-2-one,2h-1-benzopyran-2-one,4-hydroxy-3-nitro,4-hydroxy-3-hydroxy oxido amino-2h-chromen-2-one,acmc-20amh1,maybridge1_005221 PubChem CID: 54682640 IUPAC Name: 4-hydroxy-3-nitrochromen-2-one SMILES: C1=CC=C2C(=C1)C(=C(C(=O)O2)[N+](=O)[O-])O

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Specifications

PubChem CID	54682640
CAS	20261-31-8
Molecular Weight (g/mol)	207.141
MDL Number	MFCD00051671
SMILES	C1=CC=C2C(=C1)C(=C(C(=O)O2)[N+](=O)[O-])O
Synonym	4-hydroxy-3-nitrocoumarin,4-hydroxy-3-nitro-2h-chromen-2-one,3-nitro-4-hydroxycoumarin,2h-1-benzopyran-2-one, 4-hydroxy-3-nitro,2-hydroxy-3-nitrochromen-4-one,4-hydroxy-3-nitro-chromen-2-one,2h-1-benzopyran-2-one,4-hydroxy-3-nitro,4-hydroxy-3-hydroxy oxido amino-2h-chromen-2-one,acmc-20amh1,maybridge1_005221
IUPAC Name	4-hydroxy-3-nitrochromen-2-one
InChI Key	NZQAQAUWFHMVEM-UHFFFAOYSA-N
Molecular Formula	C9H5NO5

124

3-Acetamidocoumarin 98.0+%, TCI America™

CAS: 779-30-6 Molecular Formula: C11H9NO3 Molecular Weight (g/mol): 203.20 MDL Number: MFCD00075556 InChI Key: XJYLCCJIDYSFMB-UHFFFAOYSA-N PubChem CID: 136620 IUPAC Name: N-(2-oxo-2H-chromen-3-yl)acetamide SMILES: CC(=O)NC1=CC2=CC=CC=C2OC1=O

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Specifications

PubChem CID	136620
CAS	779-30-6
Molecular Weight (g/mol)	203.20
MDL Number	MFCD00075556
SMILES	CC(=O)NC1=CC2=CC=CC=C2OC1=O
IUPAC Name	N-(2-oxo-2H-chromen-3-yl)acetamide
InChI Key	XJYLCCJIDYSFMB-UHFFFAOYSA-N
Molecular Formula	C11H9NO3

125

3-Acetyl-6-bromocoumarin 96.0+%, TCI America™

CAS: 2199-93-1 Molecular Formula: C11H7BrO3 Molecular Weight (g/mol): 267.08 MDL Number: MFCD00024075 InChI Key: XFQYOFLFNKCHLG-UHFFFAOYSA-N Synonym: 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one PubChem CID: 304813 IUPAC Name: 3-acetyl-6-bromo-2H-chromen-2-one SMILES: CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O

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PubChem CID	304813
CAS	2199-93-1
Molecular Weight (g/mol)	267.08
MDL Number	MFCD00024075
SMILES	CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O
Synonym	3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one
IUPAC Name	3-acetyl-6-bromo-2H-chromen-2-one
InChI Key	XFQYOFLFNKCHLG-UHFFFAOYSA-N
Molecular Formula	C11H7BrO3

126

Br-Mmc (=4-Bromomethyl-7-methoxycoumarin) 98.0+%, TCI America™

CAS: 35231-44-8 Molecular Formula: C11H9BrO3 Molecular Weight (g/mol): 269.09 MDL Number: MFCD00006869 InChI Key: CTENSLORRMFPDH-UHFFFAOYSA-N Synonym: 4-bromomethyl-7-methoxycoumarin,4-bromomethyl-7-methoxy-2h-chromen-2-one,br-mmc,ccris 7996,4-bromomethyl-7-methoxychromen-2-one,2h-1-benzopyran-2-one, 4-bromomethyl-7-methoxy,4-bromomethyl-7-methoxy-2-oxo-2h-benzopyran,acmc-1agnd,4-brommethyl-7-methoxy-2h-chromen-2-on,4-bromomethyl-7-methoxy coumarin PubChem CID: 121894 IUPAC Name: 4-(bromomethyl)-7-methoxy-2H-chromen-2-one SMILES: COC1=CC=C2C(CBr)=CC(=O)OC2=C1

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Specifications

PubChem CID	121894
CAS	35231-44-8
Molecular Weight (g/mol)	269.09
MDL Number	MFCD00006869
SMILES	COC1=CC=C2C(CBr)=CC(=O)OC2=C1
Synonym	4-bromomethyl-7-methoxycoumarin,4-bromomethyl-7-methoxy-2h-chromen-2-one,br-mmc,ccris 7996,4-bromomethyl-7-methoxychromen-2-one,2h-1-benzopyran-2-one, 4-bromomethyl-7-methoxy,4-bromomethyl-7-methoxy-2-oxo-2h-benzopyran,acmc-1agnd,4-brommethyl-7-methoxy-2h-chromen-2-on,4-bromomethyl-7-methoxy coumarin
IUPAC Name	4-(bromomethyl)-7-methoxy-2H-chromen-2-one
InChI Key	CTENSLORRMFPDH-UHFFFAOYSA-N
Molecular Formula	C11H9BrO3

127

4-Bromomethyl-6,7-dimethoxycoumarin 98.0+%, TCI America™

CAS: 88404-25-5 Molecular Formula: C12H11BrO4 Molecular Weight (g/mol): 299.12 MDL Number: MFCD00011570 InChI Key: JGODLBJJCNQFII-UHFFFAOYSA-N Synonym: 4-bromomethyl-6,7-dimethoxycoumarin,4-bromomethyl-6,7-dimethoxy-2h-chromen-2-one,4-bromomethyl-6,7-dimethoxychromen-2-one,2h-1-benzopyran-2-one, 4-bromomethyl-6,7-dimethoxy,4-bromomethyl-6,7-dimethoxy coumarin,4-bdmc,brdmc-4,6,7,4-bromomethyl-6,7-dimethoxy-2-oxo-2h-benzopyran PubChem CID: 128870 IUPAC Name: 4-(bromomethyl)-6,7-dimethoxychromen-2-one SMILES: COC1=C(C=C2C(=C1)C(=CC(=O)O2)CBr)OC

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Specifications

PubChem CID	128870
CAS	88404-25-5
Molecular Weight (g/mol)	299.12
MDL Number	MFCD00011570
SMILES	COC1=C(C=C2C(=C1)C(=CC(=O)O2)CBr)OC
Synonym	4-bromomethyl-6,7-dimethoxycoumarin,4-bromomethyl-6,7-dimethoxy-2h-chromen-2-one,4-bromomethyl-6,7-dimethoxychromen-2-one,2h-1-benzopyran-2-one, 4-bromomethyl-6,7-dimethoxy,4-bromomethyl-6,7-dimethoxy coumarin,4-bdmc,brdmc-4,6,7,4-bromomethyl-6,7-dimethoxy-2-oxo-2h-benzopyran
IUPAC Name	4-(bromomethyl)-6,7-dimethoxychromen-2-one
InChI Key	JGODLBJJCNQFII-UHFFFAOYSA-N
Molecular Formula	C12H11BrO4

128

Osthole 98.0+%, TCI America™

CAS: 484-12-8 Molecular Formula: C15H16O3 Molecular Weight (g/mol): 244.29 MDL Number: MFCD00076049 InChI Key: MBRLOUHOWLUMFF-UHFFFAOYSA-N Synonym: 7-Methoxy-8-(3-methyl-2-butenyl)coumarin PubChem CID: 10228 ChEBI: CHEBI:69832 IUPAC Name: 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one SMILES: CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C

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PubChem CID	10228
CAS	484-12-8
Molecular Weight (g/mol)	244.29
ChEBI	CHEBI:69832
MDL Number	MFCD00076049
SMILES	CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C
Synonym	7-Methoxy-8-(3-methyl-2-butenyl)coumarin
IUPAC Name	7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
InChI Key	MBRLOUHOWLUMFF-UHFFFAOYSA-N
Molecular Formula	C15H16O3

129

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

CAS: 2555-29-5 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00100602 InChI Key: WZOMQVFUPMLOGT-UHFFFAOYSA-N Synonym: 8-Acetyl-4-methylumbelliferone PubChem CID: 5324648 IUPAC Name: 8-acetyl-7-hydroxy-4-methyl-2H-chromen-2-one SMILES: CC(=O)C1=C2OC(=O)C=C(C)C2=CC=C1O

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Specifications

PubChem CID	5324648
CAS	2555-29-5
Molecular Weight (g/mol)	218.21
MDL Number	MFCD00100602
SMILES	CC(=O)C1=C2OC(=O)C=C(C)C2=CC=C1O
Synonym	8-Acetyl-4-methylumbelliferone
IUPAC Name	8-acetyl-7-hydroxy-4-methyl-2H-chromen-2-one
InChI Key	WZOMQVFUPMLOGT-UHFFFAOYSA-N
Molecular Formula	C12H10O4

130

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

CAS: 6295-35-8 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00635101 InChI Key: KNGPIBWCWOQBEK-UHFFFAOYSA-N PubChem CID: 223821 IUPAC Name: 6-methoxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=C1C=C(C=C2)OC

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PubChem CID	223821
CAS	6295-35-8
Molecular Weight (g/mol)	190.198
MDL Number	MFCD00635101
SMILES	CC1=CC(=O)OC2=C1C=C(C=C2)OC
IUPAC Name	6-methoxy-4-methylchromen-2-one
InChI Key	KNGPIBWCWOQBEK-UHFFFAOYSA-N
Molecular Formula	C11H10O3

131

3-Acetylcoumarin 98.0+%, TCI America™

CAS: 3949-36-8 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.182 MDL Number: MFCD00006853 InChI Key: CSPIFKKOBWYOEX-UHFFFAOYSA-N Synonym: 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 PubChem CID: 77553 IUPAC Name: 3-acetylchromen-2-one SMILES: CC(=O)C1=CC2=CC=CC=C2OC1=O

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PubChem CID	77553
CAS	3949-36-8
Molecular Weight (g/mol)	188.182
MDL Number	MFCD00006853
SMILES	CC(=O)C1=CC2=CC=CC=C2OC1=O
Synonym	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
IUPAC Name	3-acetylchromen-2-one
InChI Key	CSPIFKKOBWYOEX-UHFFFAOYSA-N
Molecular Formula	C11H8O3

132

Coumarin-3-carbonitrile 98.0+%, TCI America™

CAS: 15119-34-3 Molecular Formula: C10H5NO2 Molecular Weight (g/mol): 171.16 MDL Number: MFCD00115699 InChI Key: QKJALQPLNMEDAV-UHFFFAOYSA-N Synonym: 3-cyanocoumarin,2-oxo-2h-chromene-3-carbonitrile,coumarin-3-carbonitrile,2h-1-benzopyran-3-carbonitrile, 2-oxo,2-oxo-2h-1-benzopyran-3-carbonitrile,coumarin, 3-cyano-7ci,8ci,3-cyano-coumarin,pubchem8675,acmc-1cfdq PubChem CID: 203763 IUPAC Name: 2-oxo-2H-chromene-3-carbonitrile SMILES: O=C1OC2=CC=CC=C2C=C1C#N

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Specifications

PubChem CID	203763
CAS	15119-34-3
Molecular Weight (g/mol)	171.16
MDL Number	MFCD00115699
SMILES	O=C1OC2=CC=CC=C2C=C1C#N
Synonym	3-cyanocoumarin,2-oxo-2h-chromene-3-carbonitrile,coumarin-3-carbonitrile,2h-1-benzopyran-3-carbonitrile, 2-oxo,2-oxo-2h-1-benzopyran-3-carbonitrile,coumarin, 3-cyano-7ci,8ci,3-cyano-coumarin,pubchem8675,acmc-1cfdq
IUPAC Name	2-oxo-2H-chromene-3-carbonitrile
InChI Key	QKJALQPLNMEDAV-UHFFFAOYSA-N
Molecular Formula	C10H5NO2

133

6-Nitrocoumarin 98.0+%, TCI America™

CAS: 2725-81-7 Molecular Formula: C9H5NO4 Molecular Weight (g/mol): 191.142 MDL Number: MFCD00016973 InChI Key: RMERXEXZXIVNBF-UHFFFAOYSA-N Synonym: 6-nitrocoumarin,6-nitro-2h-chromen-2-one,6-nitro-2-benzopyrone,2h-1-benzopyran-2-one, 6-nitro,acmc-20abd6,maybridge1_002226,amtgc084,6-nitro-2h-chromen-2-one #,2h-1-benzopyran-2-one,6-nitro,6-hydroxy oxido amino-2h-chromen-2-one PubChem CID: 75944 IUPAC Name: 6-nitrochromen-2-one SMILES: C1=CC2=C(C=CC(=O)O2)C=C1[N+](=O)[O-]

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Specifications

PubChem CID	75944
CAS	2725-81-7
Molecular Weight (g/mol)	191.142
MDL Number	MFCD00016973
SMILES	C1=CC2=C(C=CC(=O)O2)C=C1[N+](=O)[O-]
Synonym	6-nitrocoumarin,6-nitro-2h-chromen-2-one,6-nitro-2-benzopyrone,2h-1-benzopyran-2-one, 6-nitro,acmc-20abd6,maybridge1_002226,amtgc084,6-nitro-2h-chromen-2-one #,2h-1-benzopyran-2-one,6-nitro,6-hydroxy oxido amino-2h-chromen-2-one
IUPAC Name	6-nitrochromen-2-one
InChI Key	RMERXEXZXIVNBF-UHFFFAOYSA-N
Molecular Formula	C9H5NO4

134

3-Cyanoumbelliferone 98.0+%, TCI America™

CAS: 19088-73-4 Molecular Formula: C10H5NO3 Molecular Weight (g/mol): 187.15 MDL Number: MFCD00037480 InChI Key: IJQYTHQDUDCJEQ-UHFFFAOYSA-N Synonym: 3-Cyano-7-hydroxycoumarin PubChem CID: 5393173 IUPAC Name: 7-hydroxy-2-oxo-2H-chromene-3-carbonitrile SMILES: OC1=CC=C2C=C(C#N)C(=O)OC2=C1

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Specifications

PubChem CID	5393173
CAS	19088-73-4
Molecular Weight (g/mol)	187.15
MDL Number	MFCD00037480
SMILES	OC1=CC=C2C=C(C#N)C(=O)OC2=C1
Synonym	3-Cyano-7-hydroxycoumarin
IUPAC Name	7-hydroxy-2-oxo-2H-chromene-3-carbonitrile
InChI Key	IJQYTHQDUDCJEQ-UHFFFAOYSA-N
Molecular Formula	C10H5NO3

135

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

CAS: 2555-28-4 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00009773 InChI Key: UDFPKNSWSYBIHO-UHFFFAOYSA-N Synonym: 7-methoxy-4-methylcoumarin,7-methoxy-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-methoxy-4-methyl,4-methylherniarin,hymecromone methyl ether,herniarin, 4-methyl,7-methoxy-4-methyl-chromen-2-one,4-methyl-7-methoxycoumarin,coumarin,4-methyl-7-methoxy,coumarin, 7-methoxy-4-methyl PubChem CID: 390807 IUPAC Name: 7-methoxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC

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Specifications

PubChem CID	390807
CAS	2555-28-4
Molecular Weight (g/mol)	190.198
MDL Number	MFCD00009773
SMILES	CC1=CC(=O)OC2=C1C=CC(=C2)OC
Synonym	7-methoxy-4-methylcoumarin,7-methoxy-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-methoxy-4-methyl,4-methylherniarin,hymecromone methyl ether,herniarin, 4-methyl,7-methoxy-4-methyl-chromen-2-one,4-methyl-7-methoxycoumarin,coumarin,4-methyl-7-methoxy,coumarin, 7-methoxy-4-methyl
IUPAC Name	7-methoxy-4-methylchromen-2-one
InChI Key	UDFPKNSWSYBIHO-UHFFFAOYSA-N
Molecular Formula	C11H10O3

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