CCCCCCCC1CC(C(=O)OCCOc2ccccc2)C(=O)O1
SMILES: CCCCCCCC1CC(C(=O)OCCOc2ccccc2)C(=O)O1

Molecular Processing

Molecular formula
C20H28O5
Molecular weight
348.44
Exact mass
348.1937
XLogP
3.9
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
94.26

Supplementary Information

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