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

Details

Stereochemistry ACHIRAL
Molecular Formula C3H4Br2O
Molecular Weight 215.871
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Dibromoacetone

SMILES

CC(=O)C(Br)Br

InChI

InChIKey=ZABBFAHZPHMIJC-UHFFFAOYSA-N
InChI=1S/C3H4Br2O/c1-2(6)3(4)5/h3H,1H3

HIDE SMILES / InChI

Molecular Formula C3H4Br2O
Molecular Weight 215.871
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 Mon Mar 31 22:21:07 GMT 2025
Edited
by admin
on Mon Mar 31 22:21:07 GMT 2025
Record UNII
J624SZ77MM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1-Dibromo-2-propanone
Preferred Name English
1,1-Dibromoacetone
Systematic Name English
1,1-Dibromopropanone
Systematic Name English
2-Propanone, 1,1-dibromo-
Systematic Name English
Code System Code Type Description
PUBCHEM
540118
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
CAS
867-54-9
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
FDA UNII
J624SZ77MM
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID9021558
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY