SMILES:
N#Cc1ccc2cc(C(=O)Cl)ccc2c1Molecular Processing
Molecular formula
C12H6ClNO
Molecular weight
215.64
Exact mass
215.0138
XLogP
3.09
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
58.85
Supplementary Information
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