SMILES:
COCC1CC(C(=O)O)N(C(=O)OC(C)(C)C)C1Molecular Processing
Molecular formula
C12H21NO5
Molecular weight
259.3
Exact mass
259.142
XLogP
1.34
TPSA
76.07
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
64.35
Supplementary Information
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