4-(3-Fluoropyridin-4-yl)benzonitrile

HCID 10856435
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Basic information

Standard SMILES
N#Cc1ccc(-c2ccncc2F)cc1
InChIKey
XMTQYGZZUHXZOC-UHFFFAOYSA-N
Molecular formula
C12H7FN2
Average molar mass
198.2 g/mol

Names & identifiers

Preferred name
4-(3-Fluoropyridin-4-yl)benzonitrile
IUPAC
4-(3-fluoro-4-pyridinyl)benzonitrile

Names & synonyms

4-(3-fluoropyridin-4-yl)benzonitrile144397-72-8SCHEMBL9987705XMTQYGZZUHXZOC-UHFFFAOYSA-N4-(3-Fluoro-4-pyridinyl)benzonitrileDB-379662

Database identifiers

PubChem CID
10856435

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
36.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
15

Related reactions

2 records
New reaction record

Linked notes

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