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

Molecular Processing

Molecular formula
C13H22O4
Molecular weight
242.31
Exact mass
242.1518
XLogP
2.45
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.846
Molar refractivity
63.38

Supplementary Information

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