SMILES:
CCOC(=O)C1(CCOC)CCC(O)CC1Molecular Processing
Molecular formula
C12H22O4
Molecular weight
230.3
Exact mass
230.1518
XLogP
1.51
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.917
Molar refractivity
60.03
Supplementary Information
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