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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9N3O2
Molecular Weight 203.1974
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Methyl-2-(1H-1,2,3-triazol-1-yl)benzoic acid

SMILES

CC1=CC=C(N2C=CN=N2)C(=C1)C(O)=O

InChI

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

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-(1H-1,2,3-Triazol-1-yl)-5-methylbenzoic acid
Preferred Name English
5-Methyl-2-(1H-1,2,3-triazol-1-yl)benzoic acid
Systematic Name English
Benzoic acid, 5-methyl-2-(1H-1,2,3-triazol-1-yl)-
Systematic Name English
Code System Code Type Description
FDA UNII
GJ8A7B5WZZ
Created by admin on Wed Apr 02 19:11:48 GMT 2025 , Edited by admin on Wed Apr 02 19:11:48 GMT 2025
PRIMARY
CAS
1149352-55-5
Created by admin on Wed Apr 02 19:11:48 GMT 2025 , Edited by admin on Wed Apr 02 19:11:48 GMT 2025
PRIMARY
PUBCHEM
58398973
Created by admin on Wed Apr 02 19:11:48 GMT 2025 , Edited by admin on Wed Apr 02 19:11:48 GMT 2025
PRIMARY
NIH
NCATS
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