SMILES:
COC(CNCC(=O)OCc1ccccc1)OCMolecular Processing
Molecular formula
C13H19NO4
Molecular weight
253.3
Exact mass
253.1314
XLogP
0.94
TPSA
56.79
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
66.91
Supplementary Information
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