SMILES:
CCCCCCC1(O)CCCCCCCCCCC(=O)O1Molecular Processing
Molecular formula
C18H34O3
Molecular weight
298.47
Exact mass
298.2508
XLogP
5.1
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.944
Molar refractivity
85.97
Supplementary Information
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