Phenylmethyl 1H-1,2,4-triazole-1-propanoate

CAS Registry Number®

1393441-72-9

CAS Name

Phenylmethyl 1H-1,2,4-triazole-1-propanoate

Molecular Formula

C12H13N3O2

Molecular Mass

231.25

Cite this Page

Phenylmethyl 1H-1,2,4-triazole-1-propanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1393441-72-9 (retrieved 2024-11-22) (CAS RN: 1393441-72-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H13N3O2/c16-12(6-7-15-10-13-9-14-15)17-8-11-4-2-1-3-5-11/h1-5,9-10H,6-8H2

InChIKey

InChIKey=XNOZFCJSKZPBNX-UHFFFAOYSA-N

SMILES

C(OC(CCN1C=NC=N1)=O)C2=CC=CC=C2

Canonical SMILES

O=C(OCC=1C=CC=CC1)CCN2N=CN=C2

Other Names for this Substance

  • 1H-1,2,4-Triazole-1-propanoic acid, phenylmethyl ester
  • Phenylmethyl 1H-1,2,4-triazole-1-propanoate