rel-(1R,2S)-2-[(3-Methyl-2-thienyl)carbonyl]cyclohexanecarboxylic acid

CAS Registry Number®

1443327-94-3
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CAS Name

rel-(1R,2S)-2-[(3-Methyl-2-thienyl)carbonyl]cyclohexanecarboxylic acid

Molecular Formula

C13H16O3S

Molecular Mass

252.33

Cite this Page

rel-(1R,2S)-2-[(3-Methyl-2-thienyl)carbonyl]cyclohexanecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1443327-94-3 (retrieved 2024-09-10) (CAS RN: 1443327-94-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C13H16O3S/c1-8-6-7-17-12(8)11(14)9-4-2-3-5-10(9)13(15)16/h6-7,9-10H,2-5H2,1H3,(H,15,16)/t9-,10+/s2

InChIKey

InChIKey=KLMSHHMWTVTOEW-NLJMKPLXNA-N

SMILES

C(=O)([C@H]1[C@@H](C(O)=O)CCCC1)C2=C(C)C=CS2

Canonical SMILES

O=C(O)C1CCCCC1C(=O)C=2SC=CC2C

Other Names for this Substance

  • Cyclohexanecarboxylic acid, 2-[(3-methyl-2-thienyl)carbonyl]-, (1R,2S)-rel-
  • rel-(1R,2S)-2-[(3-Methyl-2-thienyl)carbonyl]cyclohexanecarboxylic acid