SMILES:
CCCCCCCCCCCC(O)CC1OC(=O)C1CCCCCCMolecular Processing
Molecular formula
C22H42O3
Molecular weight
354.58
Exact mass
354.3134
XLogP
6.17
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
17
Heavy atoms
25
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.955
Molar refractivity
104.6
Supplementary Information
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