rel-(1R,2S)-2-[2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid

CAS Registry Number®

735275-00-0

CAS Name

rel-(1R,2S)-2-[2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid

Molecular Formula

C16H17F3O3

Molecular Mass

314.30

Cite this Page

rel-(1R,2S)-2-[2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=735275-00-0 (retrieved 2024-11-28) (CAS RN: 735275-00-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C16H17F3O3/c17-16(18,19)12-7-5-10(6-8-12)14(20)9-11-3-1-2-4-13(11)15(21)22/h5-8,11,13H,1-4,9H2,(H,21,22)/t11-,13+/s2

InChIKey

InChIKey=XQKZBVGBIMPIMD-VEZULTJBNA-N

SMILES

C(C(=O)C1=CC=C(C(F)(F)F)C=C1)[C@H]2[C@H](C(O)=O)CCCC2

Canonical SMILES

O=C(O)C1CCCCC1CC(=O)C2=CC=C(C=C2)C(F)(F)F

Other Names for this Substance

  • Cyclohexanecarboxylic acid, 2-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]-, (1R,2S)-rel-
  • rel-(1R,2S)-2-[2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl]cyclohexanecarboxylic acid

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