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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H12N2O6
Molecular Weight 352.2977
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-Bis(3-nitrophenoxy)benzene

SMILES

[O-][N+](=O)C1=CC=CC(OC2=CC=CC(OC3=CC(=CC=C3)[N+]([O-])=O)=C2)=C1

InChI

InChIKey=NYKPGQHPZCGOFF-UHFFFAOYSA-N
InChI=1S/C18H12N2O6/c21-19(22)13-4-1-6-15(10-13)25-17-8-3-9-18(12-17)26-16-7-2-5-14(11-16)20(23)24/h1-12H

HIDE SMILES / InChI

Approval Year

Name Type Language
1,3-Bis(3-nitrophenoxy)benzene
Systematic Name English
Benzene, 1,3-bis(3-nitrophenoxy)-
Systematic Name English
1,3-Bis(m-nitrophenoxy)benzene
Systematic Name English
Code System Code Type Description
FDA UNII
A3JA3W73XC
Created by admin on Sat Dec 16 12:41:51 GMT 2023 , Edited by admin on Sat Dec 16 12:41:51 GMT 2023
PRIMARY
ECHA (EC/EINECS)
258-945-1
Created by admin on Sat Dec 16 12:41:51 GMT 2023 , Edited by admin on Sat Dec 16 12:41:51 GMT 2023
PRIMARY
PUBCHEM
104683
Created by admin on Sat Dec 16 12:41:51 GMT 2023 , Edited by admin on Sat Dec 16 12:41:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID4068905
Created by admin on Sat Dec 16 12:41:51 GMT 2023 , Edited by admin on Sat Dec 16 12:41:51 GMT 2023
PRIMARY
CAS
54060-31-0
Created by admin on Sat Dec 16 12:41:51 GMT 2023 , Edited by admin on Sat Dec 16 12:41:51 GMT 2023
PRIMARY