Название: α-Bromo-p-tolyl cyclobutyl ketone
SMILES:
O=C(c1ccc(CBr)cc1)C1CCC1Molecular Processing
Molecular formula
C12H13BrO
Molecular weight
253.14
Exact mass
252.015
XLogP
3.56
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
60.74
Supplementary Information
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