3-[(Cyclohexylthio)methyl]-2-benzofurancarboxylic acid

CAS Registry Number®

568559-40-0
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CAS Name

3-[(Cyclohexylthio)methyl]-2-benzofurancarboxylic acid

Molecular Formula

C16H18O3S

Molecular Mass

290.38

Cite this Page

3-[(Cyclohexylthio)methyl]-2-benzofurancarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=568559-40-0 (retrieved 2024-09-10) (CAS RN: 568559-40-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H18O3S/c17-16(18)15-13(10-20-11-6-2-1-3-7-11)12-8-4-5-9-14(12)19-15/h4-5,8-9,11H,1-3,6-7,10H2,(H,17,18)

InChIKey

InChIKey=QMCFJKXBRHJGKO-UHFFFAOYSA-N

SMILES

C(SC1CCCCC1)C=2C=3C(OC2C(O)=O)=CC=CC3

Canonical SMILES

O=C(O)C=1OC=2C=CC=CC2C1CSC3CCCCC3

Other Names for this Substance

  • 2-Benzofurancarboxylic acid, 3-[(cyclohexylthio)methyl]-
  • 3-[(Cyclohexylthio)methyl]-2-benzofurancarboxylic acid