SMILES:
CC(C)(C)OC(=O)c1cnc(CCl)c(CCl)c1Molecular Processing
Molecular formula
C12H15Cl2NO2
Molecular weight
276.16
Exact mass
275.048
XLogP
3.51
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
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
0.5
Molar refractivity
68.52
Supplementary Information
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