Molecule

ID:111357

General Information
Structure
MolImage
Molecular Formula
C₄H₁₂BrN
Molecular Mass
154.04878
Exact Mass
153.01531139
Charge
0
InChI
InChI=1S/C4H12N.BrH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
InChIKey
DDFYFBUWEBINLX-UHFFFAOYSA-M
Canonic Smiles
C[N+](C)(C)C.[Br-]
Isomeric Smiles
[Br-].C[N+](C)(C)C
Calculated Properties
JChem
LogD (pH = 7.4)
-3.97
LogD (pH = 5.5)
-3.97
Log P
-3.97
Rotatable Bonds
0
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
true
Polar Surface Area
0.00
Polarizability
9.75
Molar Refractivity
35.90
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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