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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H6BrCl2NO2
Molecular Weight 371.013
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-Bromo-3-formylphenoxy)-2,6-dichlorobenzonitrile

SMILES

ClC1=CC(OC2=CC=C(Br)C(C=O)=C2)=CC(Cl)=C1C#N

InChI

InChIKey=KHHZNHGITCEDIL-UHFFFAOYSA-N
InChI=1S/C14H6BrCl2NO2/c15-12-2-1-9(3-8(12)7-19)20-10-4-13(16)11(6-18)14(17)5-10/h1-5,7H

HIDE SMILES / InChI

Molecular Formula C14H6BrCl2NO2
Molecular Weight 371.013
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 Wed Apr 02 13:19:42 GMT 2025
Edited
by admin
on Wed Apr 02 13:19:42 GMT 2025
Record UNII
RDD7S84D9E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzonitrile, 4-(4-bromo-3-formylphenoxy)-2,6-dichloro-
Preferred Name English
4-(4-Bromo-3-formylphenoxy)-2,6-dichlorobenzonitrile
Systematic Name English
Code System Code Type Description
FDA UNII
RDD7S84D9E
Created by admin on Wed Apr 02 13:19:42 GMT 2025 , Edited by admin on Wed Apr 02 13:19:42 GMT 2025
PRIMARY
CAS
2354382-28-6
Created by admin on Wed Apr 02 13:19:42 GMT 2025 , Edited by admin on Wed Apr 02 13:19:42 GMT 2025
PRIMARY
PUBCHEM
138690896
Created by admin on Wed Apr 02 13:19:42 GMT 2025 , Edited by admin on Wed Apr 02 13:19:42 GMT 2025
PRIMARY