Molecule

ID:94898

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀ClF₂O₄P
Molecular Mass
250.5647674
Exact Mass
249.99732955
Charge
0
InChI
InChI=1S/C6H10ClF2O4P/c1-3-12-14(11,13-4-2)6(8,9)5(7)10/h3-4H2,1-2H3
InChIKey
ZKYUQNZVQOGWSL-UHFFFAOYSA-N
Canonic Smiles
CCOP(=O)(C(C(=O)Cl)(F)F)OCC
Isomeric Smiles
P(=O)(C(C(=O)Cl)(F)F)(OCC)OCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.6343336
LogD (pH = 7.4)
1.6343336
Log P
1.6343336
Molar Refractivity
46.7224
Polarizability
18.462599
Polar Surface Area
52.6
Rotatable Bonds
6
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
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References
Bioactivity
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