Molecule

ID:99447

General Information
Structure
MolImage
Molecular Formula
C₉H₅F₁₃
Molecular Mass
360.1152416
Exact Mass
360.01836702
Charge
0
InChI
InChI=1S/C9H5F13/c1-2-3-4(10,11)5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)22/h2-3H,1H3
InChIKey
ZYHWHNDIVSRFMS-UHFFFAOYSA-N
Canonic Smiles
C/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Isomeric Smiles
FC(C(C(C(F)(F)F)(F)F)(F)F)(F)C(F)(C(F)(F)/C=C/C)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.74772
LogD (pH = 7.4)
5.74772
Log P
5.74772
Molar Refractivity
45.5953
Polarizability
16.726591
Polar Surface Area
0.0
Rotatable Bonds
6
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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