SMILES:
O=C1OCCC1N1CCCCC1=OMolecular Processing
Molecular formula
C9H13NO3
Molecular weight
183.21
Exact mass
183.0895
XLogP
0.31
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
44.93
Supplementary Information
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