Name: 1-(2-hydroxy-5-tetradecylphenyl)-1-hexanone
SMILES:
CCCCCCCCCCCCCCc1ccc(O)c(C(=O)CCCCC)c1Molecular Processing
Molecular formula
C26H44O2
Molecular weight
388.64
Exact mass
388.3341
XLogP
8.4
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
18
Heavy atoms
28
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.731
Molar refractivity
121.36
Supplementary Information
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