SMILES:
CCC(CC)c1cc[n+]([O-])cc1Molecular Processing
Molecular formula
C10H15NO
Molecular weight
165.24
Exact mass
165.1154
XLogP
2.22
TPSA
26.94
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
48.73
Supplementary Information
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