SMILES:
C=C1CCCCCCC(C(=O)OCC)NC1=OMolecular Processing
Molecular formula
C13H21NO3
Molecular weight
239.31
Exact mass
239.1521
XLogP
1.94
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
65.41
Supplementary Information
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