U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7N3O
Molecular Weight 149.15
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1H-Benzotriazole-1-methanol

SMILES

OCN1N=NC2=C1C=CC=C2

InChI

InChIKey=MXJIHEXYGRXHGP-UHFFFAOYSA-N
InChI=1S/C7H7N3O/c11-5-10-7-4-2-1-3-6(7)8-9-10/h1-4,11H,5H2

HIDE SMILES / InChI

Molecular Formula C7H7N3O
Molecular Weight 149.15
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 12:04:46 GMT 2025
Edited
by admin
on Wed Apr 02 12:04:46 GMT 2025
Record UNII
PY5HS4K4B4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-12463
Preferred Name English
1H-Benzotriazole-1-methanol
Systematic Name English
1-(Hydroxymethyl)benzotriazole
Systematic Name English
(1H-1,2,3-Benzotriazol-1-yl)methanol
Systematic Name English
1-(Hydroxymethyl)-1H-benzotriazole
Systematic Name English
1-Benzotriazolemethanol
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10279361
Created by admin on Wed Apr 02 12:04:46 GMT 2025 , Edited by admin on Wed Apr 02 12:04:46 GMT 2025
PRIMARY
NSC
12463
Created by admin on Wed Apr 02 12:04:46 GMT 2025 , Edited by admin on Wed Apr 02 12:04:46 GMT 2025
PRIMARY
PUBCHEM
224169
Created by admin on Wed Apr 02 12:04:46 GMT 2025 , Edited by admin on Wed Apr 02 12:04:46 GMT 2025
PRIMARY
CAS
28539-02-8
Created by admin on Wed Apr 02 12:04:46 GMT 2025 , Edited by admin on Wed Apr 02 12:04:46 GMT 2025
PRIMARY
FDA UNII
PY5HS4K4B4
Created by admin on Wed Apr 02 12:04:46 GMT 2025 , Edited by admin on Wed Apr 02 12:04:46 GMT 2025
PRIMARY