CCCCC(F)(F)C(=O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCCCC(=O)O
SMILES: CCCCC(F)(F)C(=O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCCCC(=O)O

Molecular Processing

Molecular formula
C22H34F2O5
Molecular weight
416.51
Exact mass
416.2374
XLogP
4.71
TPSA
91.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
15
Heavy atoms
29
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.773
Molar refractivity
105.8

Supplementary Information

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