4-Fluoropyrrolidine-2-carbonitrile

HCID 17856473
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Basic information

Standard SMILES
N#CC1CC(F)CN1
InChIKey
HHFUFGKACHWIAV-UHFFFAOYSA-N
Molecular formula
C5H7FN2
Average molar mass
114.12 g/mol

Names & identifiers

Preferred name
4-Fluoropyrrolidine-2-carbonitrile
IUPAC
4-fluoropyrrolidine-2-carbonitrile

Names & synonyms

4-fluoropyrrolidine-2-carbonitrile1558370-80-1(2S,4S)-4-FLUORO-PYRROLIDINE-2-CARBONITRILESCHEMBL894918SCHEMBL4418391CHEMBL2448950AB39350EN300-1726069

Database identifiers

PubChem CID
17856473
ChEMBL
CHEMBL2448950

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
35.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
8

Experimental & physicochemical properties

Dissociation Constants4

Related reactions

3 records
New reaction record

Compound notes

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