SMILES:
Cl.O=C1CC2(CCNCC2)CO1Molecular Processing
Molecular formula
C8H14ClNO2
Molecular weight
191.66
Exact mass
191.0713
XLogP
0.72
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.875
Molar refractivity
47.36
Supplementary Information
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