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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H12BrClO
Molecular Weight 287.58
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Bromocyclopentyl 2-chlorophenyl ketone

SMILES

ClC1=C(C=CC=C1)C(=O)C2(Br)CCCC2

InChI

InChIKey=DDVNLGGCSRULIL-UHFFFAOYSA-N
InChI=1S/C12H12BrClO/c13-12(7-3-4-8-12)11(15)9-5-1-2-6-10(9)14/h1-2,5-6H,3-4,7-8H2

HIDE SMILES / InChI

Molecular Formula C12H12BrClO
Molecular Weight 287.58
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 Sat Dec 16 20:17:01 GMT 2023
Edited
by admin
on Sat Dec 16 20:17:01 GMT 2023
Record UNII
HX62AMW7M7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Bromocyclopentyl 2-chlorophenyl ketone
Systematic Name English
1-Bromocyclopentyl o-chlorophenyl ketone
Systematic Name English
(1-Bromocyclopentyl)(2-chlorophenyl)methanone
Systematic Name English
Methanone, (1-bromocyclopentyl)(2-chlorophenyl)-
Systematic Name English
Code System Code Type Description
CAS
6740-86-9
Created by admin on Sat Dec 16 20:17:01 GMT 2023 , Edited by admin on Sat Dec 16 20:17:01 GMT 2023
PRIMARY
FDA UNII
HX62AMW7M7
Created by admin on Sat Dec 16 20:17:01 GMT 2023 , Edited by admin on Sat Dec 16 20:17:01 GMT 2023
PRIMARY
PUBCHEM
81224
Created by admin on Sat Dec 16 20:17:01 GMT 2023 , Edited by admin on Sat Dec 16 20:17:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY