Molecule

ID:66112

General Information
Structure
MolImage
Molecular Formula
C₁₄H₁₈F₂
Molecular Mass
224.2895264
Exact Mass
224.13765702
Charge
0
InChI
InChI=1S/C14H18F2/c1-14(15,16)13-9-7-12(8-10-13)11-5-3-2-4-6-11/h7-11H,2-6H2,1H3
InChIKey
ODRLKJNRZSUVCW-UHFFFAOYSA-N
Canonic Smiles
CC(c1ccc(cc1)C1CCCCC1)(F)F
Isomeric Smiles
c1(ccc(cc1)C(C)(F)F)C1CCCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.7253857
LogD (pH = 7.4)
4.7253857
Log P
4.7253857
Molar Refractivity
62.3554
Polarizability
23.618263
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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