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1-(4-Bromophenyl)-2-(2-fluoropyridin-4-yl)ethanone

HCID 178902844
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Basic information

CAS
960214-08-8
Standard SMILES
O=C(Cc1ccnc(F)c1)c1ccc(Br)cc1
InChIKey
LHWRWTAHQQTAQR-UHFFFAOYSA-N
Molecular formula
C13H9BrFNO
Average molar mass
294.12 g/mol

Names & identifiers

Preferred name
1-(4-Bromophenyl)-2-(2-fluoropyridin-4-yl)ethanone
IUPAC
1-(4-bromophenyl)-2-(2-fluoro-4-pyridinyl)ethanone
English name
1-(4-Bromophenyl)-2-(2-fluoro-4-pyridinyl)-ethanone
Molecular formula
C13H9BrFNO
Molecular weight
294.122

Names & synonyms

SCHEMBL3618613LHWRWTAHQQTAQR-UHFFFAOYSA-N1-(4-bromophenyl)-2-(2-fluoropyridin-4-yl)ethanone1-(4-Bromophenyl)-2-(2-fluoro-4-pyridinyl)-ethanone

Database identifiers

CAS
960214-08-8

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
30 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
266

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