이름: 3-chloro-1-(4-chlorophenyl)-1-propanone
SMILES:
O=C(CCCl)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C9H8Cl2O
Molecular weight
203.07
Exact mass
201.9952
XLogP
3.15
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
51.12
Supplementary Information
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