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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H9NO2
Molecular Weight 151.1626
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Ethylnitrobenzene

SMILES

CCC1=C(C=CC=C1)[N+]([O-])=O

InChI

InChIKey=PXWYZLWEKCMTEZ-UHFFFAOYSA-N
InChI=1S/C8H9NO2/c1-2-7-5-3-4-6-8(7)9(10)11/h3-6H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H9NO2
Molecular Weight 151.1626
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 19:14:04 GMT 2025
Edited
by admin
on Tue Apr 01 19:14:04 GMT 2025
Record UNII
DZR8C3N7UE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-5095
Preferred Name English
2-Ethylnitrobenzene
Systematic Name English
Benzene, 1-ethyl-2-nitro-
Systematic Name English
o-Ethylnitrobenzene
Systematic Name English
1-Ethyl-2-nitrobenzene
Systematic Name English
Code System Code Type Description
NSC
5095
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY
FDA UNII
DZR8C3N7UE
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY
EPA CompTox
DTXSID4073209
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY
CAS
612-22-6
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY
PUBCHEM
69156
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY
ECHA (EC/EINECS)
210-299-1
Created by admin on Tue Apr 01 19:14:04 GMT 2025 , Edited by admin on Tue Apr 01 19:14:04 GMT 2025
PRIMARY