3-(4'-Pentyl-2-fluorobiphenyl-4-yl)-propionaldehyde

HCID 20162693
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Basic information

Standard SMILES
CCCCCc1ccc(-c2ccc(CCC=O)cc2F)cc1
InChIKey
RDDYLPHZNMFHIW-UHFFFAOYSA-N
Molecular formula
C20H23FO
Average molar mass
298.4 g/mol
Monoisotopic mass
298.17329352

Names & identifiers

Preferred name
3-(4'-Pentyl-2-fluorobiphenyl-4-yl)-propionaldehyde
IUPAC
3-[3-fluoro-4-(4-pentylphenyl)phenyl]propanal

Names & synonyms

SCHEMBL10501714RDDYLPHZNMFHIW-UHFFFAOYSA-N3-(4'-pentyl-2-fluorobiphenyl-4-yl)-propionaldehyde

Database identifiers

PubChem CID
20162693

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
22

Related reactions

2 records
New reaction record

Linked notes

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