4-[(2-Methylphenyl)thio]-3-nitrobenzoic acid

CAS Registry Number®

355816-33-0

CAS Name

4-[(2-Methylphenyl)thio]-3-nitrobenzoic acid

Molecular Formula

C14H11NO4S

Molecular Mass

289.31

Cite this Page

4-[(2-Methylphenyl)thio]-3-nitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=355816-33-0 (retrieved 2024-11-25) (CAS RN: 355816-33-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H11NO4S/c1-9-4-2-3-5-12(9)20-13-7-6-10(14(16)17)8-11(13)15(18)19/h2-8H,1H3,(H,16,17)

InChIKey

InChIKey=HXAMNVUCVOWPRU-UHFFFAOYSA-N

SMILES

S(C1=C(N(=O)=O)C=C(C(O)=O)C=C1)C2=C(C)C=CC=C2

Canonical SMILES

O=C(O)C1=CC=C(SC=2C=CC=CC2C)C(=C1)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 4-[(2-methylphenyl)thio]-3-nitro-
  • 4-[(2-Methylphenyl)thio]-3-nitrobenzoic acid

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