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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H12ClFO
Molecular Weight 214.664
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Chloro-1-(4-fluorophenyl)-1-pentanone

SMILES

FC1=CC=C(C=C1)C(=O)CCCCCl

InChI

InChIKey=UGAKAFQJJSSKJM-UHFFFAOYSA-N
InChI=1S/C11H12ClFO/c12-8-2-1-3-11(14)9-4-6-10(13)7-5-9/h4-7H,1-3,8H2

HIDE SMILES / InChI

Molecular Formula C11H12ClFO
Molecular Weight 214.664
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 20:18:59 GMT 2023
Edited
by admin
on Sat Dec 16 20:18:59 GMT 2023
Record UNII
K39P4N9BVR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Chloro-1-(4-fluorophenyl)-1-pentanone
Systematic Name English
1-(4-Fluorophenyl)-5-chloro-1-oxopentane
Systematic Name English
4-(p-Fluorobenzoyl)-1-chlorobutane
Systematic Name English
Code System Code Type Description
FDA UNII
K39P4N9BVR
Created by admin on Sat Dec 16 20:18:59 GMT 2023 , Edited by admin on Sat Dec 16 20:18:59 GMT 2023
PRIMARY
CAS
17135-46-5
Created by admin on Sat Dec 16 20:18:59 GMT 2023 , Edited by admin on Sat Dec 16 20:18:59 GMT 2023
PRIMARY
PUBCHEM
12649794
Created by admin on Sat Dec 16 20:18:59 GMT 2023 , Edited by admin on Sat Dec 16 20:18:59 GMT 2023
PRIMARY