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Compound
N-(3-fluorophenyl)-3-phenylacrylamide
HCID
727183
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Basic information
Names & identifiers
Properties
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Basic information
Standard SMILES
O=C(C=Cc1ccccc1)Nc1cccc(F)c1
InChIKey
SQJXVMSLVGLGQR-UHFFFAOYSA-N
Molecular formula
C15H12FNO
Average molar mass
241.26 g/mol
Monoisotopic mass
241.09029217
Names & identifiers
Preferred name
N-(3-fluorophenyl)-3-phenylacrylamide
IUPAC
N-(3-fluorophenyl)-3-phenylprop-2-enamide
Names & synonyms
N-(3-fluorophenyl)-3-phenylacrylamide
CBMicro_009158
SCHEMBL705746
SQJXVMSLVGLGQR-UHFFFAOYSA-N
Database identifiers
PubChem CID
727183
Properties
Computed structural properties
XLogP
3.7
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
297
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
289034
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
1644303
As reactant
uspto-grants-2012_02
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