Molecule

ID:7345

General Information
Structure
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Molecular Formula
C₆H₄ClF
Molecular Mass
130.5473632
Exact Mass
129.99855603
Charge
0
InChI
InChI=1S/C6H4ClF/c7-5-2-1-3-6(8)4-5/h1-4H
InChIKey
VZHJIJZEOCBKRA-UHFFFAOYSA-N
Canonic Smiles
Fc1cccc(c1)Cl
Isomeric Smiles
c1(F)cc(Cl)ccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.7199924
LogD (pH = 7.4)
2.7199924
Log P
2.7199924
Molar Refractivity
31.0792
Polarizability
11.900165
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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