4-(Butylthio)benzoic acid

CAS Registry Number®

22683-49-4
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CAS Name

4-(Butylthio)benzoic acid

Molecular Formula

C11H14O2S

Molecular Mass

210.29

Cite this Page

4-(Butylthio)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22683-49-4 (retrieved 2024-09-03) (CAS RN: 22683-49-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    122 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14O2S/c1-2-3-8-14-10-6-4-9(5-7-10)11(12)13/h4-7H,2-3,8H2,1H3,(H,12,13)

InChIKey

InChIKey=MBTLMIJJXJIUDA-UHFFFAOYSA-N

SMILES

S(CCCC)C1=CC=C(C(O)=O)C=C1

Canonical SMILES

O=C(O)C1=CC=C(SCCCC)C=C1

Other Names for this Substance

  • Benzoic acid, 4-(butylthio)-
  • Benzoic acid, p-(butylthio)-
  • 4-(Butylthio)benzoic acid
  • NSC 138411