Molecule

ID:94255

General Information
Structure
MolImage
Molecular Formula
C₇H₃Cl₄F
Molecular Mass
247.9091232
Exact Mass
245.89728904
Charge
0
InChI
InChI=1S/C7H3Cl4F/c8-4-2-1-3-5(12)6(4)7(9,10)11/h1-3H
InChIKey
PNAGDDZKFJHOOK-UHFFFAOYSA-N
Canonic Smiles
Fc1cccc(c1C(Cl)(Cl)Cl)Cl
Isomeric Smiles
Clc1c(c(ccc1)F)C(Cl)(Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.2179008
LogD (pH = 7.4)
4.2179008
Log P
4.2179008
Molar Refractivity
51.5573
Polarizability
19.529982
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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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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