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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H3F2N
Molecular Weight 139.1022
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-Difluorobenzonitrile

SMILES

FC1=CC=C(F)C(=C1)C#N

InChI

InChIKey=OJTMHIMQUQOLJV-UHFFFAOYSA-N
InChI=1S/C7H3F2N/c8-6-1-2-7(9)5(3-6)4-10/h1-3H

HIDE SMILES / InChI

Molecular Formula C7H3F2N
Molecular Weight 139.1022
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 12:21:14 GMT 2023
Edited
by admin
on Sat Dec 16 12:21:14 GMT 2023
Record UNII
KV4R6B8YXU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-Difluorobenzonitrile
Systematic Name English
Benzonitrile, 2,5-difluoro-
Systematic Name English
Code System Code Type Description
FDA UNII
KV4R6B8YXU
Created by admin on Sat Dec 16 12:21:14 GMT 2023 , Edited by admin on Sat Dec 16 12:21:14 GMT 2023
PRIMARY
ECHA (EC/EINECS)
264-753-9
Created by admin on Sat Dec 16 12:21:14 GMT 2023 , Edited by admin on Sat Dec 16 12:21:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID20214465
Created by admin on Sat Dec 16 12:21:14 GMT 2023 , Edited by admin on Sat Dec 16 12:21:14 GMT 2023
PRIMARY
PUBCHEM
123558
Created by admin on Sat Dec 16 12:21:14 GMT 2023 , Edited by admin on Sat Dec 16 12:21:14 GMT 2023
PRIMARY
CAS
64248-64-2
Created by admin on Sat Dec 16 12:21:14 GMT 2023 , Edited by admin on Sat Dec 16 12:21:14 GMT 2023
PRIMARY