SMILES:
CCCCC[C@@H]1OC(=O)[C@]1(CCCC)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C20H28O4
Molecular weight
332.44
Exact mass
332.1988
XLogP
4.41
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
92.22
Supplementary Information
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