3-(4-Mercaptophenyl)propanoic acid

CAS Registry Number®

63545-55-1
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CAS Name

3-(4-Mercaptophenyl)propanoic acid

Molecular Formula

C9H10O2S

Molecular Mass

182.24

Cite this Page

3-(4-Mercaptophenyl)propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=63545-55-1 (retrieved 2024-04-28) (CAS RN: 63545-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    100-105 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H10O2S/c10-9(11)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,12H,3,6H2,(H,10,11)

InChIKey

InChIKey=YQWPHBFLHAJVCG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCC1=CC=C(S)C=C1

Other Names for this Substance

  • Benzenepropanoic acid, 4-mercapto-
  • Hydrocinnamic acid, p-mercapto-
  • 4-Mercaptobenzenepropanoic acid
  • 4-Mercaptodihydrocinnamic acid
  • 3-(4-Mercaptophenyl)propionic acid

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