Molecule

ID:89184

General Information
Structure
MolImage
Molecular Formula
C₈H₂₀BrN
Molecular Mass
210.1551
Exact Mass
209.07791165
Charge
0
InChI
InChI=1S/C8H20N.BrH/c1-5-9(6-2,7-3)8-4;/h5-8H2,1-4H3;1H/q+1;/p-1
InChIKey
HWCKGOZZJDHMNC-UHFFFAOYSA-M
Canonic Smiles
CC[N+](CC)(CC)CC.[Br-]
Isomeric Smiles
[N+](CC)(CC)(CC)CC.[Br-]
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
-2.5449352
LogD (pH = 7.4)
-2.5449352
Log P
-2.5449352
Molar Refractivity
54.8961
Polarizability
16.958946
Polar Surface Area
0.0
Rotatable Bonds
4
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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