2-(2-Pyrimidinylthio)acetic acid

CAS Registry Number®

88768-45-0

CAS Name

2-(2-Pyrimidinylthio)acetic acid

Molecular Formula

C6H6N2O2S

Molecular Mass

170.19

Cite this Page

2-(2-Pyrimidinylthio)acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88768-45-0 (retrieved 2024-11-22) (CAS RN: 88768-45-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    199-200 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H6N2O2S/c9-5(10)4-11-6-7-2-1-3-8-6/h1-3H,4H2,(H,9,10)

InChIKey

InChIKey=NIEOYUNNKKAQKI-UHFFFAOYSA-N

SMILES

S(CC(O)=O)C=1N=CC=CN1

Canonical SMILES

O=C(O)CSC1=NC=CC=N1

Other Names for this Substance

  • Acetic acid, 2-(2-pyrimidinylthio)-
  • Acetic acid, (2-pyrimidinylthio)-
  • 2-(2-Pyrimidinylthio)acetic acid
  • (2-Pyrimidylthio)acetic acid
  • [(Pyrimidin-2-yl)thio]acetic acid

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Deleted or Replaced CAS Registry Numbers

1397283-63-4