SMILES:
CON=CC1=CCCN(C(=O)OC(C)Cl)C1Molecular Processing
Molecular formula
C10H15ClN2O3
Molecular weight
246.69
Exact mass
246.0771
XLogP
1.97
TPSA
51.13
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
61.57
Supplementary Information
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