Molecule

ID:103908

General Information
Structure
MolImage
Molecular Formula
C₈H₂₀ClN
Molecular Mass
165.7041
Exact Mass
165.12842733
Charge
0
InChI
InChI=1S/C8H20N.ClH/c1-5-9(6-2,7-3)8-4;/h5-8H2,1-4H3;1H/q+1;/p-1
InChIKey
YMBCJWGVCUEGHA-UHFFFAOYSA-M
Canonic Smiles
CC[N+](CC)(CC)CC.[Cl-]
Isomeric Smiles
[Cl-].CC[N+](CC)(CC)CC
Calculated Properties
JChem
LogD (pH = 7.4)
-2.54
LogD (pH = 5.5)
-2.54
Log P
-2.54
Rotatable Bonds
4
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
true
Polar Surface Area
0.00
Polarizability
17.32
Molar Refractivity
54.90
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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