Molecule

ID:99402

General Information
Structure
MolImage
Molecular Formula
C₃Cl₃F₅
Molecular Mass
237.383116
Exact Mass
235.89857414
Charge
0
InChI
InChI=1S/C3Cl3F5/c4-1(7,2(5,8)9)3(6,10)11
InChIKey
AIDLQDHQDQZVQM-UHFFFAOYSA-N
Canonic Smiles
FC(C(Cl)(F)F)(C(Cl)(F)F)Cl
Isomeric Smiles
FC(Cl)(C(F)(Cl)C(F)(Cl)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.6291604
LogD (pH = 7.4)
3.6291604
Log P
3.6291604
Molar Refractivity
32.1253
Polarizability
12.082821
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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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