SMILES:
OCC1CCCN1Cc1ccccc1Molecular Processing
Molecular formula
C12H17NO
Molecular weight
191.27
Exact mass
191.131
XLogP
1.64
TPSA
23.47
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
56.96
Supplementary Information
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