SMILES:
CNCC1COc2ccccc2OC1.ClMolecular Processing
Molecular formula
C11H16ClNO2
Molecular weight
229.71
Exact mass
229.087
XLogP
1.72
TPSA
30.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.455
Molar refractivity
62.1
Supplementary Information
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