SMILES:
Cc1c(C#N)cccc1C#NMolecular Processing
Molecular formula
C9H6N2
Molecular weight
142.16
Exact mass
142.0531
XLogP
1.74
TPSA
47.58
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
40.61
Supplementary Information
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