Molecule

ID:9140

General Information
Structure
MolImage
Molecular Formula
C₆HF₁₃
Molecular Mass
320.0513816
Exact Mass
319.98706689
Charge
0
InChI
InChI=1S/C6HF13/c7-1(8)2(9,10)3(11,12)4(13,14)5(15,16)6(17,18)19/h1H
InChIKey
XJSRKJAHJGCPGC-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F
Isomeric Smiles
C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)(F)F
Calculated Properties
JChem
Acid pKa
19.786736
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.395528
LogD (pH = 7.4)
4.395528
Log P
4.395528
Molar Refractivity
30.6515
Polarizability
12.255487
Polar Surface Area
0.0
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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