Molecule

ID:110227

General Information
Structure
MolImage
Molecular Formula
C₂H₆MnO₆
Molecular Mass
181.003489
Exact Mass
180.95448301
Charge
0
InChI
InChI=1S/2CH2O2.Mn.2H2O/c2*2-1-3;;;/h2*1H,(H,2,3);;2*1H2/q;;+2;;/p-2
InChIKey
SQWDGUOWCZUSAO-UHFFFAOYSA-L
Canonic Smiles
[O-]C=O.[O-]C=O.O.O.[Mn+2]
Isomeric Smiles
O.O.[Mn+2].[O-]C=O.[O-]C=O
Calculated Properties
JChem
Acid pKa
4.269118
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-1.5255477
LogD (pH = 7.4)
-3.257304
Log P
-0.27204442
Molar Refractivity
18.9903
Polarizability
3.1383486
Polar Surface Area
40.13
Rotatable Bonds
0
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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