Molecule

ID:59456

General Information
Structure
MolImage
Molecular Formula
C₆H₉ClF₂
Molecular Mass
154.5854664
Exact Mass
154.03608441
Charge
0
InChI
InChI=1S/C6H9ClF2/c7-5-3-1-2-4-6(5,8)9/h5H,1-4H2
InChIKey
NBLOIUSLEWOOKM-UHFFFAOYSA-N
Canonic Smiles
ClC1CCCCC1(F)F
Isomeric Smiles
C1(C(CCCC1)Cl)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.662658
LogD (pH = 7.4)
2.662658
Log P
2.662658
Molar Refractivity
32.5039
Polarizability
12.512594
Polar Surface Area
0.0
Rotatable Bonds
0
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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