Nombre: (S)-3-decyl-(S)-4-[(R)-2-hydroxy-5-hexenyl)-2-oxetanone
SMILES:
C=CCC[C@@H](O)C[C@@H]1OC(=O)[C@H]1CCCCCCCCCCMolecular Processing
Molecular formula
C19H34O3
Molecular weight
310.48
Exact mass
310.2508
XLogP
4.78
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
14
Heavy atoms
22
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.842
Molar refractivity
90.65
Supplementary Information
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