Molecule
ID:80422
General Information
Molecular Formula
C₇H₁₃Cl
Molecular Mass
132.63112
Exact Mass
132.0705781
Charge
0
InChI
InChI=1S/C7H13Cl/c1-7(8)5-3-2-4-6-7/h2-6H2,1H3
InChIKey
OGYBTPYJHQSBBR-UHFFFAOYSA-N
Canonic Smiles
CC1(Cl)CCCCC1
Isomeric Smiles
ClC1(C)CCCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.915862
LogD (pH = 7.4)
2.915862
Log P
2.915862
Molar Refractivity
36.9647
Polarizability
14.709335
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
No Data Available
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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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