Coumarin-3-carboxylic acid
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Coumarin-3-carboxylic acid
structure -
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CAS No:
531-81-7
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Formula:
C10H6O4
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Chemical Name:
Coumarin-3-carboxylic acid
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Synonyms:
2H-1-Benzopyran-3-carboxylic acid,2-oxo-;1,2-Benzopyran-3-carboxylic acid,2-keto-;2-Oxo-2H-1-benzopyran-3-carboxylic acid;Coumarin-3-carboxylic acid;G 1 (rodenticide);3-Carboxycoumarin;G 1;3-Carboxylcoumarin;NSC 14797;NSC 44926;NSC 53239;2H-1-Benzopyran-2-one-3-carboxylic acid;2-Oxo-2H-chromene-3-carboxylic acid;2-Oxochromene-3-carboxylic acid
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CAS No:
Description
Coumarin-3-carboxylic acid (2- Oxochromene-3-carboxylic acid) is an important initial compound for the synthesis of coumarins which are well known natural products for their diverse biological activities. Lanthanide complexes of Coumarin-3-carboxylic acid exhibit antiproliferative activity towards K-562 cell line[1][2].
Coumarin-3-carboxylic acid Basic Attributes
190.15
190.15
208-518-0
V85UOV8788
53239|44926|14797
DTXSID70201183
2932209090
Safety Information
II
6.1
UN 2811 6.1/PG 3
3
R25
S36/37/39-S45-S28A
DJ2490000
T:Toxic;
P264, P270, P301+P310, P321, P330, P405, P501
H301
Computed Properties
Molecular Weight:190.15
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:190.02660867
Monoisotopic Mass:190.02660867
Topological Polar Surface Area:63.6
Heavy Atom Count:14
Complexity:305
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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