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3-(4-Fluorophenyl)-1-phenylprop-2-en-1-one

HCID 98201
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C(C=Cc1ccc(F)cc1)c1ccccc1
InChIKey
NYSCQZARWVHQBE-UHFFFAOYSA-N
Molecular formula
C15H11FO
Average molar mass
226.24 g/mol

Names & identifiers

Preferred name
3-(4-Fluorophenyl)-1-phenylprop-2-en-1-one
IUPAC
3-(4-fluorophenyl)-1-phenylprop-2-en-1-one

Names & synonyms

3-(4-fluorophenyl)-1-phenylprop-2-en-1-oneMFCD004434672-(4-Fluorobenzal)acetophenoneNCIOpen2_005449SCHEMBL657888NYSCQZARWVHQBE-UHFFFAOYSA-N2-(4-Fluorobenzylidene)acetophenoneAKOS025393513PS-77653-(4-Fluoro-phenyl)-1-phenyl-propenoneDB-043471F0459
Show more names
3-(4-fluorophenyl)-1-phenyl-prop-2-en-1-one

Database identifiers

PubChem CID
98201

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
271

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Related reactions

10 records
New reaction record
HRID 22191 reaction equation
HRID 22191As productuspto-grants-1995_06
HRID 120193 reaction equation
HRID 120193As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 326288 reaction equation
HRID 326288As productuspto-grants-1993_12
HRID 949431 reaction equation
HRID 949431As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1402886 reaction equation
HRID 1402886As productuspto-grants-2014_12
HRID 1569537 reaction equation
HRID 1569537As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1646984 reaction equation
HRID 1646984As productuspto-grants-1993_01
HRID 1720735 reaction equation
HRID 1720735As productuspto-grants-1996_04
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Compound notes

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