Molecule

ID:8843

General Information
Structure
MolImage
Molecular Formula
C₁₀H₅F₁₇
Molecular Mass
448.1195544
Exact Mass
448.0119799
Charge
0
InChI
InChI=1S/C10H5F17/c1-2-3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h2H2,1H3
InChIKey
JNAIMEWMJYVGEW-UHFFFAOYSA-N
Canonic Smiles
CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Isomeric Smiles
FC(C(C(C(C(C(C(C(CC)(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)
6.681749
LogD (pH = 7.4)
6.681749
Log P
6.681749
Molar Refractivity
49.4781
Polarizability
19.203718
Polar Surface Area
0.0
Rotatable Bonds
8
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
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References
Bioactivity
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