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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H5F2N
Molecular Weight 117.0967
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1-Difluoro-3-isocyanocyclobutane

SMILES

FC1(F)CC(C1)[N+]#[C-]

InChI

InChIKey=KYWJPXYKFWQBID-UHFFFAOYSA-N
InChI=1S/C5H5F2N/c1-8-4-2-5(6,7)3-4/h4H,2-3H2

HIDE SMILES / InChI

Approval Year

Name Type Language
1,1-Difluoro-3-isocyanocyclobutane
Systematic Name English
(3,3-Difluorocyclobutyl)isonitrile
Preferred Name English
Cyclobutane, 1,1-difluoro-3-isocyano-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID301297742
Created by admin on Wed Apr 02 17:55:54 GMT 2025 , Edited by admin on Wed Apr 02 17:55:54 GMT 2025
PRIMARY
PUBCHEM
86690595
Created by admin on Wed Apr 02 17:55:54 GMT 2025 , Edited by admin on Wed Apr 02 17:55:54 GMT 2025
PRIMARY
FDA UNII
4MF5RCD7WT
Created by admin on Wed Apr 02 17:55:54 GMT 2025 , Edited by admin on Wed Apr 02 17:55:54 GMT 2025
PRIMARY
CAS
1355328-31-2
Created by admin on Wed Apr 02 17:55:54 GMT 2025 , Edited by admin on Wed Apr 02 17:55:54 GMT 2025
PRIMARY