이름: title compound
SMILES:
CC(O)(c1ccc(F)cc1)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C14H12ClFO
Molecular weight
250.7
Exact mass
250.0561
XLogP
3.73
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
66.52
Supplementary Information
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