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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H10BrNO4
Molecular Weight 324.127
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Bromo-1-methoxy-2-(4-nitrophenoxy)benzene

SMILES

COC1=C(OC2=CC=C(C=C2)[N+]([O-])=O)C=C(Br)C=C1

InChI

InChIKey=INITWIZQTGTCFY-UHFFFAOYSA-N
InChI=1S/C13H10BrNO4/c1-18-12-7-2-9(14)8-13(12)19-11-5-3-10(4-6-11)15(16)17/h2-8H,1H3

HIDE SMILES / InChI

Molecular Formula C13H10BrNO4
Molecular Weight 324.127
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 18:21:05 GMT 2025
Edited
by admin
on Tue Apr 01 18:21:05 GMT 2025
Record UNII
4SK5WWD3QJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Bromo-1-methoxy-2-(4-nitrophenoxy)benzene
Systematic Name English
3-Bromo-6-methoxy-1-(4-nitrophenoxy)benzene
Preferred Name English
Benzene, 4-bromo-1-methoxy-2-(4-nitrophenoxy)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
282-703-4
Created by admin on Tue Apr 01 18:21:05 GMT 2025 , Edited by admin on Tue Apr 01 18:21:05 GMT 2025
PRIMARY
PUBCHEM
3019838
Created by admin on Tue Apr 01 18:21:05 GMT 2025 , Edited by admin on Tue Apr 01 18:21:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID90233269
Created by admin on Tue Apr 01 18:21:05 GMT 2025 , Edited by admin on Tue Apr 01 18:21:05 GMT 2025
PRIMARY
FDA UNII
4SK5WWD3QJ
Created by admin on Tue Apr 01 18:21:05 GMT 2025 , Edited by admin on Tue Apr 01 18:21:05 GMT 2025
PRIMARY
CAS
84304-18-7
Created by admin on Tue Apr 01 18:21:05 GMT 2025 , Edited by admin on Tue Apr 01 18:21:05 GMT 2025
PRIMARY