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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H8Br2O
Molecular Weight 291.967
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[3-Bromo-4-(bromomethyl)phenyl]ethanone

SMILES

CC(=O)C1=CC(Br)=C(CBr)C=C1

InChI

InChIKey=YCYQORKDKUHNBO-UHFFFAOYSA-N
InChI=1S/C9H8Br2O/c1-6(12)7-2-3-8(5-10)9(11)4-7/h2-4H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H8Br2O
Molecular Weight 291.967
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 19:16:29 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:29 GMT 2025
Record UNII
FK7YPY35GF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[3-Bromo-4-(bromomethyl)phenyl]ethan-1-one
Preferred Name English
1-[3-Bromo-4-(bromomethyl)phenyl]ethanone
Systematic Name English
Ethanone, 1-[3-bromo-4-(bromomethyl)phenyl]-
Systematic Name English
Code System Code Type Description
CAS
909190-70-1
Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025
PRIMARY
FDA UNII
FK7YPY35GF
Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025
PRIMARY
PUBCHEM
58092080
Created by admin on Wed Apr 02 19:16:29 GMT 2025 , Edited by admin on Wed Apr 02 19:16:29 GMT 2025
PRIMARY