Nombre: 1-benzyl-4-cyano-4-hydroxypiperidine hydrochloride
SMILES:
Cl.N#CC1(O)CCN(Cc2ccccc2)CC1Molecular Processing
Molecular formula
C13H17ClN2O
Molecular weight
252.74
Exact mass
252.1029
XLogP
1.96
TPSA
47.26
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.462
Molar refractivity
68.76
Supplementary Information
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