Molecule

ID:98022

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₉F₆N₂P
Molecular Mass
312.2354402
Exact Mass
312.11900457
Charge
0
InChI
InChI=1S/C10H19N2.F6P/c1-3-4-5-6-7-12-9-8-11(2)10-12;1-7(2,3,4,5)6/h8-10H,3-7H2,1-2H3;/q+1;-1
InChIKey
YPWSSSRXUOQNMQ-UHFFFAOYSA-N
Canonic Smiles
F[P-](F)(F)(F)(F)F.CCCCCCn1cc[n+](c1)C
Isomeric Smiles
n1(c[n+](cc1)C)CCCCCC.[P-](F)(F)(F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
-1.2568401
LogD (pH = 7.4)
-1.2568401
Log P
-1.2568401
Molar Refractivity
51.9283
Polarizability
20.132729
Polar Surface Area
8.81
Rotatable Bonds
5
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
No Data Available
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Molecule Details
References
Bioactivity
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