Name: 38A
SMILES:
CC1Cc2c(N)c(Cl)cc(Cl)c2O1Molecular Processing
Molecular formula
C9H9Cl2NO
Molecular weight
218.08
Exact mass
217.0061
XLogP
2.9
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
54.67
Supplementary Information
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