Benzoic acid, 3-[(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-, hydrochloride (1:1)

CAS Registry Number®

1431963-49-3
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CAS Name

Benzoic acid, 3-[(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-, hydrochloride (1:1)

Molecular Formula

C13H15N3O2.ClH

Cite this Page

Benzoic acid, 3-[(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1431963-49-3 (retrieved 2024-09-08) (CAS RN: 1431963-49-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15N3O2.ClH/c1-8-12(14)9(2)16(15-8)7-10-4-3-5-11(6-10)13(17)18;/h3-6H,7,14H2,1-2H3,(H,17,18);1H

InChIKey

InChIKey=XAQRPXXPXABUET-UHFFFAOYSA-N

SMILES

C(N1C(C)=C(N)C(C)=N1)C2=CC(C(O)=O)=CC=C2.Cl

Canonical SMILES

Cl.O=C(O)C1=CC=CC(=C1)CN2N=C(C(N)=C2C)C

Other Names for this Substance

  • Benzoic acid, 3-[(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-, hydrochloride (1:1)