Molecule

ID:123354

General Information
Structure
MolImage
Molecular Formula
C₂H₂Br₂O
Molecular Mass
201.84468
Exact Mass
199.84723868
Charge
0
InChI
InChI=1S/C2H2Br2O/c3-1-2(4)5/h1H2
InChIKey
LSTRKXWIZZZYAS-UHFFFAOYSA-N
Canonic Smiles
BrCC(=O)Br
Isomeric Smiles
C(=O)(Br)CBr
Calculated Properties
JChem
Acid pKa
17.103619
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.1828758
LogD (pH = 7.4)
1.1828758
Log P
1.1828758
Molar Refractivity
26.8378
Polarizability
10.783257
Polar Surface Area
17.07
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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