SMILES:
COC(=O)c1ccc(-c2cc(CCl)on2)cc1Molecular Processing
Molecular formula
C12H10ClNO3
Molecular weight
251.67
Exact mass
251.0349
XLogP
2.87
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
62.84
Supplementary Information
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