3-[(1-Carboxyethyl)thio]-2-methylpropanoic acid

CAS Registry Number®

106014-16-8
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CAS Name

3-[(1-Carboxyethyl)thio]-2-methylpropanoic acid

Molecular Formula

C7H12O4S

Molecular Mass

192.23

Cite this Page

3-[(1-Carboxyethyl)thio]-2-methylpropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=106014-16-8 (retrieved 2024-09-06) (CAS RN: 106014-16-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H12O4S/c1-4(6(8)9)3-12-5(2)7(10)11/h4-5H,3H2,1-2H3,(H,8,9)(H,10,11)

InChIKey

InChIKey=YFXYLSSOKGLAKG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C(SCC(C(=O)O)C)C

Other Names for this Substance

  • Propanoic acid, 3-[(1-carboxyethyl)thio]-2-methyl-
  • 3-[(1-Carboxyethyl)thio]-2-methylpropanoic acid
  • 2,5-Dimethyl-3-thiaadipic acid
  • 3-[(1-Carboxyethyl)sulfanyl]-2-methylpropanoic acid