Molecule
ID:98476
General Information
Molecular Formula
C₆H₁₀F₂
Molecular Mass
120.1404064
Exact Mass
120.07505676
Charge
0
InChI
InChI=1S/C6H10F2/c1-2-3-4-5-6(7)8/h5H,2-4H2,1H3
InChIKey
OABXUFVTRAEJRN-UHFFFAOYSA-N
Canonic Smiles
CCCCC=C(F)F
Isomeric Smiles
FC(=CCCCC)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.0062997
LogD (pH = 7.4)
3.0062997
Log P
3.0062997
Molar Refractivity
40.5819
Polarizability
11.019782
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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