CC(C)(C)OC(=O)NC(C(=O)O)C1CCCCC1
SMILES: CC(C)(C)OC(=O)NC(C(=O)O)C1CCCCC1

Molecular Processing

Molecular formula
C13H23NO4
Molecular weight
257.33
Exact mass
257.1627
XLogP
2.54
TPSA
75.63
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.846
Molar refractivity
67.37

Supplementary Information

Details werden geladen…

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