SMILES:
O=Cc1cccc(OCCN2CCCC2)c1Molecular Processing
Molecular formula
C13H17NO2
Molecular weight
219.28
Exact mass
219.1259
XLogP
1.97
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
63
Supplementary Information
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