4-[(4-Oxo-2-thioxo-5-thiazolidinylidene)methyl]benzoic acid

CAS Registry Number®

103987-82-2

CAS Name

4-[(4-Oxo-2-thioxo-5-thiazolidinylidene)methyl]benzoic acid

Molecular Formula

C11H7NO3S2

Molecular Mass

265.31

Cite this Page

4-[(4-Oxo-2-thioxo-5-thiazolidinylidene)methyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103987-82-2 (retrieved 2024-11-24) (CAS RN: 103987-82-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    307-308 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H7NO3S2/c13-9-8(17-11(16)12-9)5-6-1-3-7(4-2-6)10(14)15/h1-5H,(H,14,15)(H,12,13,16)

InChIKey

InChIKey=CEGWYNRNQDQLNJ-UHFFFAOYSA-N

SMILES

C(=C1SC(=S)NC1=O)C2=CC=C(C(O)=O)C=C2

Canonical SMILES

O=C(O)C1=CC=C(C=C1)C=C2SC(=S)NC2=O

Other Names for this Substance

  • Benzoic acid, 4-[(4-oxo-2-thioxo-5-thiazolidinylidene)methyl]-
  • p-Toluic acid, α-(4-oxo-2-thioxo-5-thiazolidinylidene)-
  • 4-[(4-Oxo-2-thioxo-5-thiazolidinylidene)methyl]benzoic acid
  • NSC 409063

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