1-(3-Chlorophenyl)-3-(4-pyridyl)-butane

HCID 19783364
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Basic information

Standard SMILES
CC(CCc1cccc(Cl)c1)c1ccncc1
InChIKey
KLHXTBHCMJRIFX-UHFFFAOYSA-N
Molecular formula
C15H16ClN
Average molar mass
245.74 g/mol

Names & identifiers

Preferred name
1-(3-Chlorophenyl)-3-(4-pyridyl)-butane
IUPAC
4-[4-(3-chlorophenyl)butan-2-yl]pyridine

Names & synonyms

SCHEMBL9587600KLHXTBHCMJRIFX-UHFFFAOYSA-N1-(3-chlorophenyl)-3-(4-pyridyl)-butane

Database identifiers

PubChem CID
19783364

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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