Molecule

ID:97228

General Information
Structure
Molecular Formula
C₁₀H₁₀B₂F₈N₂
Molecular Mass
331.8090256
Exact Mass
332.09023489
Charge
0
InChI
InChI=1S/C5H5FN.C5H5N.B2F7/c6-7-4-2-1-3-5-7;1-2-4-6-5-3-1;3-1(4,5)9-2(6,7)8/h1-5H;1-5H;/q+1;;-1
InChIKey
SWZORICHKHSIOP-UHFFFAOYSA-N
Canonic Smiles
c1cccnc1.F[B]([F-][B](F)(F)F)(F)F.F[n+]1ccccc1
Isomeric Smiles
[n+]1(ccccc1)F.n1ccccc1.[B]([F-][B](F)(F)F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
Molar Refractivity
10.5091
Polar Surface Area
0.0
Rotatable Bonds
2
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
References
Bioactivity
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