SMILES:
CCCC(C#N)C(C=O)CCMolecular Processing
Molecular formula
C9H15NO
Molecular weight
153.22
Exact mass
153.1154
XLogP
2.15
TPSA
40.86
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
43.86
Supplementary Information
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