5-Phenyl-2H-tetrazole-2-butanoic acid

CAS Registry Number®

21054-69-3
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CAS Name

5-Phenyl-2H-tetrazole-2-butanoic acid

Molecular Formula

C11H12N4O2

Molecular Mass

232.24

Cite this Page

5-Phenyl-2H-tetrazole-2-butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21054-69-3 (retrieved 2024-09-11) (CAS RN: 21054-69-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12N4O2/c16-10(17)7-4-8-15-13-11(12-14-15)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,16,17)

InChIKey

InChIKey=WSRYMQSWEWOMRO-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)N1N=C(N=N1)C2=CC=CC=C2

Canonical SMILES

O=C(O)CCCN1N=NC(=N1)C2=CC=CC=C2

Other Names for this Substance

  • 2H-Tetrazole-2-butanoic acid, 5-phenyl-
  • 2H-Tetrazole-2-butyric acid, 5-phenyl-
  • 5-Phenyl-2H-tetrazole-2-butanoic acid