4-(Mercaptomethyl)-2,6-pyridinedicarboxylic acid

CAS Registry Number®

1040401-18-0

CAS Name

4-(Mercaptomethyl)-2,6-pyridinedicarboxylic acid

Molecular Formula

C8H7NO4S

Molecular Mass

213.21

Cite this Page

4-(Mercaptomethyl)-2,6-pyridinedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1040401-18-0 (retrieved 2024-11-29) (CAS RN: 1040401-18-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H7NO4S/c10-7(11)5-1-4(3-14)2-6(9-5)8(12)13/h1-2,14H,3H2,(H,10,11)(H,12,13)

InChIKey

InChIKey=WSVZILXOOFJPGD-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1N=C(C(O)=O)C=C(CS)C1

Canonical SMILES

O=C(O)C=1N=C(C=C(C1)CS)C(=O)O

Other Names for this Substance

  • 2,6-Pyridinedicarboxylic acid, 4-(mercaptomethyl)-
  • 4-(Mercaptomethyl)-2,6-pyridinedicarboxylic acid

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