Molecule

ID:69402

General Information
Structure
MolImage
Molecular Formula
C₂H₇Br₂N
Molecular Mass
204.89168
Exact Mass
202.89452323
Charge
0
InChI
InChI=1S/C2H6BrN.BrH/c3-1-2-4;/h1-2,4H2;1H
InChIKey
WJAXXWSZNSFVNG-UHFFFAOYSA-N
Canonic Smiles
NCCBr.Br
Isomeric Smiles
NCCBr.Br
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.5470865
LogD (pH = 7.4)
-1.0099831
Log P
0.22452624
Molar Refractivity
22.2456
Polarizability
8.794316
Polar Surface Area
26.02
Rotatable Bonds
1
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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