Molecule

ID:12104

General Information
Structure
MolImage
Molecular Formula
C₆F₁₀O₃
Molecular Mass
310.046432
Exact Mass
309.96877606
Charge
0
InChI
InChI=1S/C6F10O3/c7-2(4(9,10)11)1(17)18-3(8,5(12,13)14)6(15,16)19-2
InChIKey
CWRPQPNYDDMAMA-UHFFFAOYSA-N
Canonic Smiles
O=C1OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F
Isomeric Smiles
O1C(=O)C(OC(C1(C(F)(F)F)F)(F)F)(C(F)(F)F)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.9004393
LogD (pH = 7.4)
3.9004393
Log P
3.9004393
Molar Refractivity
33.0259
Polarizability
13.1398735
Polar Surface Area
35.53
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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