O=C(CBr)c1ccc(F)cc1F
Name: 2-bromo-2′,4′-difluoroacetophenone
SMILES: O=C(CBr)c1ccc(F)cc1F

Molecular Processing

Molecular formula
C8H5BrF2O
Molecular weight
235.03
Exact mass
233.9492
XLogP
2.54
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
44.48

Supplementary Information

Details werden geladen…

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