Molecule

ID:8099

General Information
Structure
Molecular Formula
C₁₀H₁₇F₃
Molecular Mass
194.2371896
Exact Mass
194.1282352
Charge
0
InChI
InChI=1S/C10H17F3/c1-2-3-4-5-6-7-8-9(11)10(12)13/h2-8H2,1H3
InChIKey
VAKNUCCHIZRRRF-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCC(=C(F)F)F
Isomeric Smiles
C(=C(F)CCCCCCCC)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.4040875
LogD (pH = 7.4)
4.4040875
Log P
4.4040875
Molar Refractivity
59.2677
Polarizability
18.121183
Polar Surface Area
0.0
Rotatable Bonds
7
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
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References
Bioactivity
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