Molecule

ID:8008

General Information
Structure
MolImage
Molecular Formula
C₃H₃F₅O
Molecular Mass
150.047336
Exact Mass
150.01040582
Charge
0
InChI
InChI=1S/C3H3F5O/c4-2(5)9-1-3(6,7)8/h2H,1H2
InChIKey
ZASBKNPRLPFSCA-UHFFFAOYSA-N
Canonic Smiles
FC(OCC(F)(F)F)F
Isomeric Smiles
O(CC(F)(F)F)C(F)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.006404
LogD (pH = 7.4)
2.006404
Log P
2.006404
Molar Refractivity
18.4715
Polarizability
6.982298
Polar Surface Area
9.23
Rotatable Bonds
3
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
References
Bioactivity
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