COC(=O)C(C)(C)CN
SMILES: COC(=O)C(C)(C)CN

Molecular Processing

Molecular formula
C6H13NO2
Molecular weight
131.17
Exact mass
131.0946
XLogP
0.14
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
34.85

Supplementary Information

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