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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N2O5
Molecular Weight 198.1329
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

OCC1=C(C=CC=C1[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=JOFAFRXWWUXIEE-UHFFFAOYSA-N
InChI=1S/C7H6N2O5/c10-4-5-6(8(11)12)2-1-3-7(5)9(13)14/h1-3,10H,4H2

HIDE SMILES / InChI

Molecular Formula C7H6N2O5
Molecular Weight 198.1329
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 Sat Dec 16 08:15:15 GMT 2023
Edited
by admin
on Sat Dec 16 08:15:15 GMT 2023
Record UNII
9UMY598ETG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-DINITROBENZYL ALCOHOL
Systematic Name English
BENZENEMETHANOL, 2,6-DINITRO-
Systematic Name English
2,6-DINITROBENZENEMETHANOL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10914285
Created by admin on Sat Dec 16 08:15:15 GMT 2023 , Edited by admin on Sat Dec 16 08:15:15 GMT 2023
PRIMARY
PUBCHEM
119332
Created by admin on Sat Dec 16 08:15:15 GMT 2023 , Edited by admin on Sat Dec 16 08:15:15 GMT 2023
PRIMARY
FDA UNII
9UMY598ETG
Created by admin on Sat Dec 16 08:15:15 GMT 2023 , Edited by admin on Sat Dec 16 08:15:15 GMT 2023
PRIMARY
CAS
96839-34-8
Created by admin on Sat Dec 16 08:15:15 GMT 2023 , Edited by admin on Sat Dec 16 08:15:15 GMT 2023
PRIMARY