Name: 2-methoxycarbonylmethyltetrahydroquinoline hydrochloride
SMILES:
COC(=O)CC1CCc2ccccc2N1.ClMolecular Processing
Molecular formula
C12H16ClNO2
Molecular weight
241.72
Exact mass
241.087
XLogP
2.4
TPSA
38.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.417
Molar refractivity
66.05
Supplementary Information
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