SMILES:
OCCCCCCCCCCCCCCCCCCc1ccc(I)cc1Molecular Processing
Molecular formula
C24H41IO
Molecular weight
472.5
Exact mass
472.2202
XLogP
8.07
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
18
Heavy atoms
26
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
0.75
Molar refractivity
123.82
Supplementary Information
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