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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7N3O5
Molecular Weight 213.1476
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-2,6-DINITROBENZYL ALCOHOL

SMILES

NC1=CC(=C(CO)C(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=DTEYAKYAIQIMOY-UHFFFAOYSA-N
InChI=1S/C7H7N3O5/c8-4-1-6(9(12)13)5(3-11)7(2-4)10(14)15/h1-2,11H,3,8H2

HIDE SMILES / InChI

Approval Year

Name Type Language
4-AMINO-2,6-DINITROBENZYL ALCOHOL
Systematic Name English
4-AMINO-2,6-DINITROBENZENEMETHANOL
Preferred Name English
BENZENEMETHANOL, 4-AMINO-2,6-DINITRO-
Systematic Name English
Code System Code Type Description
FDA UNII
G72YBJ77ID
Created by admin on Tue Apr 01 19:35:16 GMT 2025 , Edited by admin on Tue Apr 01 19:35:16 GMT 2025
PRIMARY
PUBCHEM
2762522
Created by admin on Tue Apr 01 19:35:16 GMT 2025 , Edited by admin on Tue Apr 01 19:35:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID70945338
Created by admin on Tue Apr 01 19:35:16 GMT 2025 , Edited by admin on Tue Apr 01 19:35:16 GMT 2025
PRIMARY
CAS
226711-12-2
Created by admin on Tue Apr 01 19:35:16 GMT 2025 , Edited by admin on Tue Apr 01 19:35:16 GMT 2025
PRIMARY