rel-(1R,2S)-2-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid

CAS Registry Number®

735274-97-2
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CAS Name

rel-(1R,2S)-2-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid

Molecular Formula

C15H17IO3

Molecular Mass

372.20

Cite this Page

rel-(1R,2S)-2-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=735274-97-2 (retrieved 2024-06-26) (CAS RN: 735274-97-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C15H17IO3/c16-12-7-5-10(6-8-12)14(17)9-11-3-1-2-4-13(11)15(18)19/h5-8,11,13H,1-4,9H2,(H,18,19)/t11-,13+/s2

InChIKey

InChIKey=PBRAGIZIEINLNK-VEZULTJBNA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Cyclohexanecarboxylic acid, 2-[2-(4-iodophenyl)-2-oxoethyl]-, (1R,2S)-rel-
  • rel-(1R,2S)-2-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid

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