Molecule

ID:97442

General Information
Structure
MolImage
Molecular Formula
C₁₉H₃₁F₃Sn
Molecular Mass
435.1456496
Exact Mass
436.13997965
Charge
0
InChI
InChI=1S/C7H4F3.3C4H9.Sn/c8-7(9,10)6-4-2-1-3-5-6;3*1-3-4-2;/h2-5H;3*1,3-4H2,2H3;
InChIKey
HPTXTUCJAKOFES-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1ccc(cc1)C(F)(F)F)(CCCC)CCCC
Isomeric Smiles
[Sn](c1ccc(cc1)C(F)(F)F)(CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
6.0137
LogD (pH = 7.4)
6.0137
Log P
6.0137
Molar Refractivity
89.8637
Polarizability
38.86883
Polar Surface Area
0.0
Rotatable Bonds
11
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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