Molecule

ID:35515

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅Cl₂N
Molecular Mass
184.1067
Exact Mass
183.05815485
Charge
0
InChI
InChI=1S/C7H14ClN.ClH/c8-4-3-7-9-5-1-2-6-9;/h1-7H2;1H
InChIKey
UUPCYQIIQHSPKR-UHFFFAOYSA-N
Canonic Smiles
ClCCCN1CCCC1.Cl
Isomeric Smiles
N1(CCCCl)CCCC1.Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-2.0180855
LogD (pH = 7.4)
-0.6157533
Log P
1.3204166
Molar Refractivity
41.7378
Polarizability
16.235283
Polar Surface Area
3.24
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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