4-[(1-Methylethyl)thio]butanoic acid

CAS Registry Number®

79313-54-5
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CAS Name

4-[(1-Methylethyl)thio]butanoic acid

Molecular Formula

C7H14O2S

Molecular Mass

162.25

Cite this Page

4-[(1-Methylethyl)thio]butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79313-54-5 (retrieved 2024-09-10) (CAS RN: 79313-54-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    110-112 °C @ Press: 1.8 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C7H14O2S/c1-6(2)10-5-3-4-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)

InChIKey

InChIKey=FLHNOANMAYVBSV-UHFFFAOYSA-N

SMILES

C(CSC(C)C)CC(O)=O

Canonical SMILES

O=C(O)CCCSC(C)C

Other Names for this Substance

  • Butanoic acid, 4-[(1-methylethyl)thio]-
  • Butyric acid, 4-(isopropylthio)-
  • 4-[(1-Methylethyl)thio]butanoic acid
  • NSC 35365