Molecule

ID:110253

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₅Cl
Molecular Mass
204.7799
Exact Mass
204.16447848
Charge
0
InChI
InChI=1S/C12H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3
InChIKey
YAYNEUUHHLGGAH-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCl
Isomeric Smiles
CCCCCCCCCCCCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.716463
LogD (pH = 7.4)
5.716463
Log P
5.716463
Molar Refractivity
61.9939
Polarizability
24.656315
Polar Surface Area
0.0
Rotatable Bonds
10
Lipinski's Rule of Five
false
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
References
Bioactivity
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