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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H6BrFO
Molecular Weight 217.035
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Bromo-1-(4-fluorophenyl)ethanone

SMILES

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

InChI

InChIKey=ZJFWCELATJMDNO-UHFFFAOYSA-N
InChI=1S/C8H6BrFO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2

HIDE SMILES / InChI

Molecular Formula C8H6BrFO
Molecular Weight 217.035
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 12:35:48 GMT 2023
Edited
by admin
on Sat Dec 16 12:35:48 GMT 2023
Record UNII
N3PVV2GVQ8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Bromo-1-(4-fluorophenyl)ethanone
Systematic Name English
2-Bromo-1-(4-fluorophenyl)ethan-1-one
Systematic Name English
NSC-88343
Code English
Ethanone, 2-bromo-1-(4-fluorophenyl)-
Systematic Name English
Code System Code Type Description
FDA UNII
N3PVV2GVQ8
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID20193307
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY
NSC
88343
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
206-955-1
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY
PUBCHEM
96749
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY
CAS
403-29-2
Created by admin on Sat Dec 16 12:35:48 GMT 2023 , Edited by admin on Sat Dec 16 12:35:48 GMT 2023
PRIMARY