Methyl 4-(1H-1,2,4-triazol-5-yl)benzoate

CAS Registry Number®

1199215-91-2
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CAS Name

Methyl 4-(1H-1,2,4-triazol-5-yl)benzoate

Molecular Formula

C10H9N3O2

Molecular Mass

203.20

Cite this Page

Methyl 4-(1H-1,2,4-triazol-5-yl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1199215-91-2 (retrieved 2024-09-08) (CAS RN: 1199215-91-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H9N3O2/c1-15-10(14)8-4-2-7(3-5-8)9-11-6-12-13-9/h2-6H,1H3,(H,11,12,13)

InChIKey

InChIKey=HBBMQBJFBRVVTI-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC=C(C=C1)C=2NC=NN2

Canonical SMILES

O=C(OC)C=1C=CC(=CC1)C2=NN=CN2

Other Names for this Substance

  • Benzoic acid, 4-(1H-1,2,4-triazol-5-yl)-, methyl ester
  • Methyl 4-(1H-1,2,4-triazol-5-yl)benzoate