SMILES:
C=CC1CCN(C(=O)OC(C)(C)C)C1COMolecular Processing
Molecular formula
C12H21NO3
Molecular weight
227.3
Exact mass
227.1521
XLogP
1.79
TPSA
49.77
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
62.12
Supplementary Information
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