Molecule

ID:104175

General Information
Structure
MolImage
Molecular Formula
C₅H₁₃Cl₂N
Molecular Mass
158.06942
Exact Mass
157.04250478
Charge
0
InChI
InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1
InChIKey
UHZZMRAGKVHANO-UHFFFAOYSA-M
Canonic Smiles
ClCC[N+](C)(C)C.[Cl-]
Isomeric Smiles
[Cl-].C[N+](C)(C)CCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
-3.3076773
LogD (pH = 7.4)
-3.3076773
Log P
-3.3076773
Molar Refractivity
45.245
Polarizability
13.225313
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
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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