Название: 1-(3-bromo-5-(trifluoromethyl)phenyl)ethanone
SMILES:
CC(=O)c1cc(Br)cc(C(F)(F)F)c1Molecular Processing
Molecular formula
C9H6BrF3O
Molecular weight
267.04
Exact mass
265.9554
XLogP
3.67
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
49.15
Supplementary Information
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