SMILES:
CC(=O)CC(C)(C)OOC(C)(C)CC(C)OMolecular Processing
Molecular formula
C12H24O4
Molecular weight
232.32
Exact mass
232.1675
XLogP
2.24
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.917
Molar refractivity
61.92
Supplementary Information
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