4-Cyanoacetyl-2',4'-difluorobiphenyl

HCID 21322542
Substructure searchFind similar structures

Basic information

Standard SMILES
N#CCC(=O)c1ccc(-c2ccc(F)cc2F)cc1
InChIKey
NEAZFOYNQSCTSS-UHFFFAOYSA-N
Molecular formula
C15H9F2NO
Average molar mass
257.23 g/mol

Names & identifiers

Preferred name
4-Cyanoacetyl-2',4'-difluorobiphenyl
IUPAC
3-[4-(2,4-difluorophenyl)phenyl]-3-oxopropanenitrile

Names & synonyms

SCHEMBL11544329NEAZFOYNQSCTSS-UHFFFAOYSA-N4-cyanoacetyl-2',4'-difluorobiphenyl

Database identifiers

PubChem CID
21322542

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
40.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19

Related reactions

3 records
New reaction record

Linked notes

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