3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid

Modify Date: 2025-08-25 05:54:49

3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid Structure
3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid structure
Common Name 3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid
CAS Number 4418-45-5 Molecular Weight 308.80000
Density 1.2g/cm3 Boiling Point 469.1ºC at 760 mmHg
Molecular Formula C17H21ClO3 Melting Point N/A
MSDS N/A Flash Point 237.5ºC

 Names

Name 3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid

 Chemical & Physical Properties

Density 1.2g/cm3
Boiling Point 469.1ºC at 760 mmHg
Molecular Formula C17H21ClO3
Molecular Weight 308.80000
Flash Point 237.5ºC
Exact Mass 308.11800
PSA 54.37000
LogP 4.12280
Index of Refraction 1.549
InChIKey WLDLYPQRSVEJCS-UHFFFAOYSA-N
SMILES CC(CC1(Cc2ccccc2Cl)CCCCC1=O)C(=O)O

 Synthetic Route

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3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid Structure

3-[1-[(2-chloro...

CAS#:4418-45-5

Literature: Fusco,R. et al. Farmaco, Edizione Scientifica, 1965 , vol. 20, p. 393 - 407

~%

3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid Structure

3-[1-[(2-chloro...

CAS#:4418-45-5

Literature: Fusco,R. et al. Farmaco, Edizione Scientifica, 1965 , vol. 20, p. 393 - 407

~%

3-[1-[(2-chlorophenyl)methyl]-2-oxocyclohexyl]-2-methylpropanoic acid Structure

3-[1-[(2-chloro...

CAS#:4418-45-5

Literature: Fusco,R. et al. Farmaco, Edizione Scientifica, 1965 , vol. 20, p. 393 - 407
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