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.

1 – 15 of 72 results

Thermo Scientific Chemicals 7-Amino-4-methylcoumarin, 98%

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-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(N)=CC=C12

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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-methylchromen-2-one
InChI Key	GLNDAGDHSLMOKX-UHFFFAOYSA-N
Molecular Formula	C10H9NO2

7-Amino-4-methylcoumarin, 98%, Thermo Scientific Chemicals

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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-methylchromen-2-one
InChI Key	GLNDAGDHSLMOKX-UHFFFAOYSA-N
Molecular Formula	C10H9NO2

Coumarin 334, 96%, Thermo Scientific Chemicals

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7-Diethylamino-4-methylcoumarin, 99%, Thermo Scientific Chemicals

CAS: 91-44-1 Molecular Formula: C14H17NO2 Molecular Weight (g/mol): 231.295 MDL Number: MFCD00006864 InChI Key: AFYCEAFSNDLKSX-UHFFFAOYSA-N Synonym: 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p PubChem CID: 7050 ChEBI: CHEBI:51938 IUPAC Name: 7-(diethylamino)-4-methylchromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C

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PubChem CID	7050
CAS	91-44-1
Molecular Weight (g/mol)	231.295
ChEBI	CHEBI:51938
MDL Number	MFCD00006864
SMILES	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C
Synonym	7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p
IUPAC Name	7-(diethylamino)-4-methylchromen-2-one
InChI Key	AFYCEAFSNDLKSX-UHFFFAOYSA-N
Molecular Formula	C14H17NO2

5,7-Dimethoxycoumarin, 98%, Thermo Scientific Chemicals

CAS: 487-06-9 Molecular Formula: C11H10O4 Molecular Weight (g/mol): 206.197 MDL Number: MFCD00006870 InChI Key: NXJCRELRQHZBQA-UHFFFAOYSA-N Synonym: 5,7-dimethoxycoumarin,citropten,limettin,citroptene,citraptene,limetin,5,7-dimethoxy-2h-chromen-2-one,5,7-dimethoxy-2-benzopyrone,2h-1-benzopyran-2-one, 5,7-dimethoxy,coumarin, 5,7-dimethoxy PubChem CID: 2775 IUPAC Name: 5,7-dimethoxychromen-2-one SMILES: COC1=CC(=C2C=CC(=O)OC2=C1)OC

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PubChem CID	2775
CAS	487-06-9
Molecular Weight (g/mol)	206.197
MDL Number	MFCD00006870
SMILES	COC1=CC(=C2C=CC(=O)OC2=C1)OC
Synonym	5,7-dimethoxycoumarin,citropten,limettin,citroptene,citraptene,limetin,5,7-dimethoxy-2h-chromen-2-one,5,7-dimethoxy-2-benzopyrone,2h-1-benzopyran-2-one, 5,7-dimethoxy,coumarin, 5,7-dimethoxy
IUPAC Name	5,7-dimethoxychromen-2-one
InChI Key	NXJCRELRQHZBQA-UHFFFAOYSA-N
Molecular Formula	C11H10O4

Coumarin-3-carboxylic acid, 98%, Thermo Scientific Chemicals

CAS: 531-81-7 Molecular Formula: C₁₀H₆O₄ Molecular Weight (g/mol): 190.15 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)	190.15
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, 98%, Thermo Scientific Chemicals

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 SMILES: O=C1OC2=CC=CC=C2C=C1

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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
InChI Key	ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Molecular Formula	C9H6O2

4-Methylumbelliferone, 97%, Thermo Scientific Chemicals

CAS: 90-33-5 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.17 MDL Number: MFCD00006866 InChI Key: HSHNITRMYYLLCV-UHFFFAOYSA-N Synonym: 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 PubChem CID: 5280567 ChEBI: CHEBI:17224 IUPAC Name: 7-hydroxy-4-methylchromen-2-one SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

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PubChem CID	5280567
CAS	90-33-5
Molecular Weight (g/mol)	176.17
ChEBI	CHEBI:17224
MDL Number	MFCD00006866
SMILES	CC1=CC(=O)OC2=CC(O)=CC=C12
Synonym	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
IUPAC Name	7-hydroxy-4-methylchromen-2-one
InChI Key	HSHNITRMYYLLCV-UHFFFAOYSA-N
Molecular Formula	C10H8O3

4-Hydroxy-3-nitrocoumarin, 98%, Thermo Scientific Chemicals

CAS: 20261-31-8 Molecular Formula: C9H5NO5 Molecular Weight (g/mol): 207.141 MDL Number: MFCD00051671 InChI Key: NZQAQAUWFHMVEM-UHFFFAOYSA-N 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
IUPAC Name	4-hydroxy-3-nitrochromen-2-one
InChI Key	NZQAQAUWFHMVEM-UHFFFAOYSA-N
Molecular Formula	C9H5NO5

Coumarin-3-carbonitrile, 97%, Thermo Scientific Chemicals

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-oxochromene-3-carbonitrile SMILES: O=C1OC2=CC=CC=C2C=C1C#N

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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-oxochromene-3-carbonitrile
InChI Key	QKJALQPLNMEDAV-UHFFFAOYSA-N
Molecular Formula	C10H5NO2

4-(Bromomethyl)-7-methoxycoumarin, 97%, Thermo Scientific Chemicals

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-methoxychromen-2-one SMILES: COC1=CC=C2C(CBr)=CC(=O)OC2=C1

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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-methoxychromen-2-one
InChI Key	CTENSLORRMFPDH-UHFFFAOYSA-N
Molecular Formula	C11H9BrO3

Coumarin-6-sulfonyl chloride, 97%, Thermo Scientific Chemicals

CAS: 10543-42-7 Molecular Formula: C9H5ClO4S Molecular Weight (g/mol): 244.65 MDL Number: MFCD01941320 InChI Key: HQIPMBGUDSOVEA-UHFFFAOYSA-N Synonym: 2-oxo-2h-chromene-6-sulfonyl chloride,coumarin-6-sulfonyl chloride,6-cs-cl,coumarin-6-sulphonyl chloride,2-oxo-2h-chromene-6-sulphonyl chloride,2-oxo-2h-1-benzopyran-6-sulfonyl chloride,6-chlorosulfonyl chromen-2-one,pubchem5506,c6scl,timtec-bb sbb002796 PubChem CID: 2735833 IUPAC Name: 2-oxochromene-6-sulfonyl chloride SMILES: ClS(=O)(=O)C1=CC=C2OC(=O)C=CC2=C1

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PubChem CID	2735833
CAS	10543-42-7
Molecular Weight (g/mol)	244.65
MDL Number	MFCD01941320
SMILES	ClS(=O)(=O)C1=CC=C2OC(=O)C=CC2=C1
Synonym	2-oxo-2h-chromene-6-sulfonyl chloride,coumarin-6-sulfonyl chloride,6-cs-cl,coumarin-6-sulphonyl chloride,2-oxo-2h-chromene-6-sulphonyl chloride,2-oxo-2h-1-benzopyran-6-sulfonyl chloride,6-chlorosulfonyl chromen-2-one,pubchem5506,c6scl,timtec-bb sbb002796
IUPAC Name	2-oxochromene-6-sulfonyl chloride
InChI Key	HQIPMBGUDSOVEA-UHFFFAOYSA-N
Molecular Formula	C9H5ClO4S

Dicumarol, Thermo Scientific Chemicals

CAS: 66-76-2 Molecular Formula: C19H12O6 Molecular Weight (g/mol): 336.30 MDL Number: MFCD00006857 InChI Key: DOBMPNYZJYQDGZ-UHFFFAOYSA-N Synonym: dicumarol,dicoumarol,bishydroxycoumarin,dicoumarin,melitoxin,antitrombosin,baracoumin,dicoumal,dicumarine,acadyl PubChem CID: 54676038 ChEBI: CHEBI:4513 IUPAC Name: 4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-one SMILES: OC1=C(CC2=C(O)C3=CC=CC=C3OC2=O)C(=O)OC2=CC=CC=C12

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PubChem CID	54676038
CAS	66-76-2
Molecular Weight (g/mol)	336.30
ChEBI	CHEBI:4513
MDL Number	MFCD00006857
SMILES	OC1=C(CC2=C(O)C3=CC=CC=C3OC2=O)C(=O)OC2=CC=CC=C12
Synonym	dicumarol,dicoumarol,bishydroxycoumarin,dicoumarin,melitoxin,antitrombosin,baracoumin,dicoumal,dicumarine,acadyl
IUPAC Name	4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-one
InChI Key	DOBMPNYZJYQDGZ-UHFFFAOYSA-N
Molecular Formula	C19H12O6

Thermo Scientific Chemicals 7-Diethylamino-4-methylcoumarin, 99%

CAS: 91-44-1 Molecular Formula: C₁₄H₁₇NO₂ Molecular Weight (g/mol): 231.29 MDL Number: MFCD00006864 InChI Key: AFYCEAFSNDLKSX-UHFFFAOYSA-N Synonym: 7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p PubChem CID: 7050 ChEBI: CHEBI:51938 IUPAC Name: 7-(diethylamino)-4-methylchromen-2-one SMILES: CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C

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PubChem CID	7050
CAS	91-44-1
Molecular Weight (g/mol)	231.29
ChEBI	CHEBI:51938
MDL Number	MFCD00006864
SMILES	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C
Synonym	7-diethylamino-4-methylcoumarin,coumarin 1,7-diethylamino-4-methyl-2h-chromen-2-one,coumarin 47,coumarin 460,4-methyl-7-diethylamino coumarin,blancophor aw,blancophor ffg,4-methyl-7-diethylaminocoumarin,hakkol p
IUPAC Name	7-(diethylamino)-4-methylchromen-2-one
InChI Key	AFYCEAFSNDLKSX-UHFFFAOYSA-N
Molecular Formula	C₁₄H₁₇NO₂

Dicumarol, 99%, Thermo Scientific Chemicals

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Specifications

PubChem CID	54676038
CAS	66-76-2
Molecular Weight (g/mol)	336.30
ChEBI	CHEBI:4513
MDL Number	MFCD00006857
SMILES	OC1=C(CC2=C(O)C3=CC=CC=C3OC2=O)C(=O)OC2=CC=CC=C12
Synonym	dicumarol,dicoumarol,bishydroxycoumarin,dicoumarin,melitoxin,antitrombosin,baracoumin,dicoumal,dicumarine,acadyl
IUPAC Name	4-hydroxy-3-[(4-hydroxy-2-oxochromen-3-yl)methyl]chromen-2-one
InChI Key	DOBMPNYZJYQDGZ-UHFFFAOYSA-N
Molecular Formula	C19H12O6

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