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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H11NO2
Molecular Weight 165.1891
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Nitromesitylene

SMILES

CC1=CC(C)=C(C(C)=C1)[N+]([O-])=O

InChI

InChIKey=SCEKDQTVGHRSNS-UHFFFAOYSA-N
InChI=1S/C9H11NO2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h4-5H,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-Nitromesitylene
Systematic Name English
Mesitylene, 2-nitro-
Systematic Name English
1,3,5-Trimethyl-2-nitrobenzene
Systematic Name English
2,4,6-Trimethylnitrobenzene
Common Name English
2,4,6-Trimethyl-1-nitrobenzene
Common Name English
Benzene, 1,3,5-trimethyl-2-nitro-
Systematic Name English
NSC-5413
Code English
Code System Code Type Description
EPA CompTox
DTXSID8060533
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY
FDA UNII
AKZ2NK5ME7
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY
PUBCHEM
69051
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY
CAS
603-71-4
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY
NSC
5413
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-054-9
Created by admin on Sat Dec 16 12:00:36 GMT 2023 , Edited by admin on Sat Dec 16 12:00:36 GMT 2023
PRIMARY