(E)-1-[3-(4-Chlorophenoxy)phenyl]buten-3-one

HCID 20073366
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Basic information

Standard SMILES
CC(=O)/C=C/c1cccc(Oc2ccc(Cl)cc2)c1
InChIKey
AANJDYGAYDXMPP-AATRIKPKSA-N
Molecular formula
C16H13ClO2
Average molar mass
272.72 g/mol

Names & identifiers

Preferred name
(E)-1-[3-(4-Chlorophenoxy)phenyl]buten-3-one
IUPAC
(E)-4-[3-(4-chlorophenoxy)phenyl]but-3-en-2-one

Names & synonyms

SCHEMBL9514207AANJDYGAYDXMPP-AATRIKPKSA-N(E)-1-[3-(4-Chlorophenoxy)phenyl]buten-3-one

Database identifiers

PubChem CID
20073366

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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