SMILES:
CCC=CC#CCCCCCCCCCCOMolecular Processing
Molecular formula
C16H28O
Molecular weight
236.4
Exact mass
236.214
XLogP
4.46
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
10
Heavy atoms
17
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
75.85
Supplementary Information
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