Molecule

ID:7875

General Information
Structure
MolImage
Molecular Formula
C₁₀F₂₁I
Molecular Mass
645.9779372
Exact Mass
645.87094062
Charge
0
InChI
InChI=1S/C10F21I/c11-1(12,3(15,16)5(19,20)7(23,24)9(27,28)29)2(13,14)4(17,18)6(21,22)8(25,26)10(30,31)32
InChIKey
UDWBMXSQHOHKOI-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(C(C(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F
Isomeric Smiles
FC(C(C(C(C(C(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
8.9096
LogD (pH = 7.4)
8.9096
Log P
8.9096
Molar Refractivity
63.1879
Polarizability
25.458477
Polar Surface Area
0.0
Rotatable Bonds
9
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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