β,3,5-Trimethyl-1H-1,2,4-triazole-1-propanoic acid

CAS Registry Number®

801228-16-0
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CAS Name

β,3,5-Trimethyl-1H-1,2,4-triazole-1-propanoic acid

Molecular Formula

C8H13N3O2

Molecular Mass

183.21

Cite this Page

β,3,5-Trimethyl-1H-1,2,4-triazole-1-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=801228-16-0 (retrieved 2024-08-11) (CAS RN: 801228-16-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H13N3O2/c1-5(4-8(12)13)11-7(3)9-6(2)10-11/h5H,4H2,1-3H3,(H,12,13)

InChIKey

InChIKey=MCTPUSHEGYKPKV-UHFFFAOYSA-N

SMILES

C(CC(O)=O)(C)N1N=C(C)N=C1C

Canonical SMILES

O=C(O)CC(N1N=C(N=C1C)C)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-1-propanoic acid, β,3,5-trimethyl-
  • β,3,5-Trimethyl-1H-1,2,4-triazole-1-propanoic acid