SMILES:
CCCCN1CCCc2ccc(C(=O)OC)cc21Molecular Processing
Molecular formula
C15H21NO2
Molecular weight
247.34
Exact mass
247.1572
XLogP
3.03
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
73.22
Supplementary Information
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