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2,2-Difluoro-1-[4-(dimethylamino)phenyl]-2-phenylethanone

HCID 15728459
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)c1ccc(C(=O)C(F)(F)c2ccccc2)cc1
InChIKey
MMPWQOMODPOIIV-UHFFFAOYSA-N
Molecular formula
C16H15F2NO
Average molar mass
275.29 g/mol

Names & identifiers

Preferred name
2,2-Difluoro-1-[4-(dimethylamino)phenyl]-2-phenylethanone
IUPAC
1-[4-(dimethylamino)phenyl]-2,2-difluoro-2-phenylethanone

Names & synonyms

2,2-difluoro-1-[4-(dimethylamino)phenyl]-2-phenylethanoneSCHEMBL9314765

Database identifiers

PubChem CID
15728459

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
329

Related reactions

4 records
New reaction record
HRID 88619 reaction equation
HRID 88619As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1084913 reaction equation
HRID 1084913As productuspto-grants-1991_04
HRID 1463372 reaction equation
HRID 1463372As productuspto-grants-1994_04
HRID 1645922 reaction equation
HRID 1645922As productuspto-grants-1993_01

Compound notes

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