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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8N2O6
Molecular Weight 228.1589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2,4-Dinitrophenoxy)ethanol

SMILES

OCCOC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=YYTMNJWMYPSLOD-UHFFFAOYSA-N
InChI=1S/C8H8N2O6/c11-3-4-16-8-2-1-6(9(12)13)5-7(8)10(14)15/h1-2,5,11H,3-4H2

HIDE SMILES / InChI

Molecular Formula C8H8N2O6
Molecular Weight 228.1589
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 Tue Apr 01 17:40:43 GMT 2025
Edited
by admin
on Tue Apr 01 17:40:43 GMT 2025
Record UNII
QWS7ZCG55M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-28669
Preferred Name English
2-(2,4-Dinitrophenoxy)ethanol
Systematic Name English
Ethanol, 2-(2,4-dinitrophenoxy)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76070
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY
ECHA (EC/EINECS)
220-597-3
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY
CAS
2831-60-9
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY
FDA UNII
QWS7ZCG55M
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY
NSC
28669
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID8062656
Created by admin on Tue Apr 01 17:40:43 GMT 2025 , Edited by admin on Tue Apr 01 17:40:43 GMT 2025
PRIMARY