CCCCC(F)(F)C(=O)CC[C@H]1[C@H](OC2CCCCO2)CC(=O)[C@@H]1CCCCCCCCC(=O)OC(C)C
Name: compound ( 19-a )
SMILES: CCCCC(F)(F)C(=O)CC[C@H]1[C@H](OC2CCCCO2)CC(=O)[C@@H]1CCCCCCCCC(=O)OC(C)C

Molecular Processing

Molecular formula
C30H50F2O6
Molecular weight
544.72
Exact mass
544.3575
XLogP
7.35
TPSA
78.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
19
Heavy atoms
38
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
141.94

Supplementary Information

Details werden geladen…

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