Molecule

ID:98577

General Information
Structure
Molecular Formula
C₄Cl₂F₇I
Molecular Mass
378.8420924
Exact Mass
377.8310009
Charge
0
InChI
InChI=1S/C4Cl2F7I/c5-1(7,3(6,10)11)2(8,9)4(12,13)14
InChIKey
YRAAQTPTEGTGOK-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(C(Cl)(F)F)(Cl)F)(F)F)(I)F
Isomeric Smiles
ClC(C(Cl)(F)F)(C(C(F)(I)F)(F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.4317
LogD (pH = 7.4)
4.4317
Log P
4.4317
Molar Refractivity
44.9332
Polarizability
17.596907
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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