Molecule

ID:12056

General Information
Structure
MolImage
Molecular Formula
C₃H₃F₅O
Molecular Mass
150.047336
Exact Mass
150.01040582
Charge
0
InChI
InChI=1S/C3H3F5O/c1-9-3(7,8)2(4,5)6/h1H3
InChIKey
GCDWNCOAODIANN-UHFFFAOYSA-N
Canonic Smiles
COC(C(F)(F)F)(F)F
Isomeric Smiles
C(C(OC)(F)F)(F)(F)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.9277843
LogD (pH = 7.4)
1.9277843
Log P
1.9277843
Molar Refractivity
19.0277
Polarizability
6.9850483
Polar Surface Area
9.23
Rotatable Bonds
2
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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