Molecule

ID:100290

General Information
Structure
MolImage
Molecular Formula
C₄H₆ClF₃
Molecular Mass
146.5386496
Exact Mass
146.01101253
Charge
0
InChI
InChI=1S/C4H6ClF3/c5-3-1-2-4(6,7)8/h1-3H2
InChIKey
OUFCPOCAIPBDNE-UHFFFAOYSA-N
Canonic Smiles
ClCCCC(F)(F)F
Isomeric Smiles
ClCCCC(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.3500752
LogD (pH = 7.4)
2.3500752
Log P
2.3500752
Molar Refractivity
25.9692
Polarizability
9.621622
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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