α-Methyl-1H-benzotriazole-1-acetic acid

CAS Registry Number®

4144-65-4

CAS Name

α-Methyl-1H-benzotriazole-1-acetic acid

Molecular Formula

C9H9N3O2

Molecular Mass

191.19

Cite this Page

α-Methyl-1H-benzotriazole-1-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4144-65-4 (retrieved 2024-10-07) (CAS RN: 4144-65-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    181-182 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9N3O2/c1-6(9(13)14)12-8-5-3-2-4-7(8)10-11-12/h2-6H,1H3,(H,13,14)

InChIKey

InChIKey=MCHYXZGLOIXABY-UHFFFAOYSA-N

SMILES

C(C(O)=O)(C)N1C=2C(N=N1)=CC=CC2

Canonical SMILES

O=C(O)C(N1N=NC=2C=CC=CC21)C

Other Names for this Substance

  • 1H-Benzotriazole-1-acetic acid, α-methyl-
  • α-Methyl-1H-benzotriazole-1-acetic acid
  • 2-(1H-1,2,3-Benzotriazol-1-yl)propanoic acid
  • 2-Benzotriazol-1-yl-propionic acid

Deleted or Replaced CAS Registry Numbers

54714-51-1

CAS INSIGHTSTM
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