Cyclohexanecarboxylic acid, 2-oxo-, methyl ester
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Cyclohexanecarboxylic acid, 2-oxo-, methyl ester
structure -
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CAS No:
41302-34-5
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Formula:
C8H12O3
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Chemical Name:
Cyclohexanecarboxylic acid, 2-oxo-, methyl ester
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Synonyms:
Cyclohexanecarboxylic acid,2-oxo-,methyl ester;Methyl 2-cyclohexanonecarboxylate;Methyl 2-oxocyclohexanecarboxylate;2-Carbomethoxycyclohexanone;2-(Methoxycarbonyl)cyclohexanone;Methyl 2-oxo-1-cyclohexanecarboxylate;Methyl 2-oxocyclohexylcarboxylate;2-Oxocyclohexanecarboxylic acid methyl ester;103533-31-9
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CAS No:
Cyclohexanecarboxylic acid, 2-oxo-, methyl ester Basic Attributes
156.18
156.18
255-306-9
2918300090
Characteristics
43.4
1.1
Clear colorless to slightly yellow Liquid
1.1±0.1 g/cm3
95-107 °C @ Press: 30 Torr
85 °C
1.464
Cyclohexanecarboxylic acid, 2-oxo-, methyl ester Use and Manufacturing
Methyl 2-Oxocyclohexanecarboxylate is a novel intermediate for the preparation of TRPA1 antagonists for treatment of pain and other TRPA1-associated diseases.
Cyclohexanecarboxylic acid, 2-oxo-, methyl ester: INACTIVE
Computed Properties
Molecular Weight:156.18
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:156.078644241
Monoisotopic Mass:156.078644241
Topological Polar Surface Area:43.4
Heavy Atom Count:11
Complexity:174
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Cyclohexanecarboxylic acid, 2-oxo-, methyl ester
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