1-Chloro-3-(4-fluorophenyl)hex-5-en-3-ol

HCID 53472938
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Basic information

Standard SMILES
C=CCC(O)(CCCl)c1ccc(F)cc1
InChIKey
PVGULZQPRGQLPQ-UHFFFAOYSA-N
Molecular formula
C12H14ClFO
Average molar mass
228.69 g/mol
Monoisotopic mass
228.0717209

Names & identifiers

Preferred name
1-Chloro-3-(4-fluorophenyl)hex-5-en-3-ol
IUPAC
1-chloro-3-(4-fluorophenyl)hex-5-en-3-ol

Names & synonyms

1-chloro-3-(4-fluorophenyl)hex-5-en-3-ol1110641-72-9SCHEMBL118861PVGULZQPRGQLPQ-UHFFFAOYSA-NDB-121327

Database identifiers

PubChem CID
53472938

Properties

Computed structural properties

XLogP
3
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
15

Related reactions

35 records
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Compound notes

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