C=Cc1cccc(C#N)c1
Name: 3-cyanostyrene
SMILES: C=Cc1cccc(C#N)c1

Molecular Processing

Molecular formula
C9H7N
Molecular weight
129.16
Exact mass
129.0578
XLogP
2.2
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
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
41.25

Supplementary Information

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