Molecule

ID:99343

General Information
Structure
Molecular Formula
C₄H₁₂F₆NP
Molecular Mass
219.1089602
Exact Mass
219.06115534
Charge
0
InChI
InChI=1S/C4H12N.F6P/c1-5(2,3)4;1-7(2,3,4,5)6/h1-4H3;/q+1;-1
InChIKey
ZFKULDQWLXAKIM-UHFFFAOYSA-N
Canonic Smiles
F[P-](F)(F)(F)(F)F.C[N+](C)(C)C
Isomeric Smiles
[N+](C)(C)(C)C.[P-](F)(F)(F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
Molar Refractivity
14.2078
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
LogD (pH = 5.5)
0.95856845
LogD (pH = 7.4)
0.95856845
Log P
2.029
Polarizability
5.0260315
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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