Molecule

ID:112140

General Information
Structure
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Molecular Formula
C₃H₇Cl
Molecular Mass
78.54068
Exact Mass
78.0236279
Charge
0
InChI
InChI=1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3
InChIKey
SNMVRZFUUCLYTO-UHFFFAOYSA-N
Canonic Smiles
CCCCl
Isomeric Smiles
CCCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.7153451
LogD (pH = 7.4)
1.7153451
Log P
1.7153451
Molar Refractivity
20.5849
Polarizability
8.079506
Polar Surface Area
0.0
Rotatable Bonds
1
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
No Data Available
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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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