C=C(C#N)c1cccc2ccccc12
SMILES: C=C(C#N)c1cccc2ccccc12

Molecular Processing

Molecular formula
C13H9N
Molecular weight
179.22
Exact mass
179.0735
XLogP
3.38
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0
Molar refractivity
58.6

Supplementary Information

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