CC(C)=CC#N
Nombre: senecionitrile
SMILES: CC(C)=CC#N

Molecular Processing

Molecular formula
C5H7N
Molecular weight
81.12
Exact mass
81.0578
XLogP
1.48
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
25.04

Supplementary Information

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