SMILES:
Cc1ccc(N=C=O)cc1ClMolecular Processing
Molecular formula
C8H6ClNO
Molecular weight
167.59
Exact mass
167.0138
XLogP
2.62
TPSA
29.43
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
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
0.125
Molar refractivity
43.97
Supplementary Information
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