Molecule

ID:108012

General Information
Structure
MolImage
Molecular Formula
C₂H₆MnO₂
Molecular Mass
117.005889
Exact Mass
116.97482453
Charge
0
InChI
InChI=1S/2CH3O.Mn/c2*1-2;/h2*1H3;/q2*-1;+2
InChIKey
UQIRCVPINUNHQY-UHFFFAOYSA-N
Canonic Smiles
C[O-].C[O-].[Mn+2]
Isomeric Smiles
[Mn+2].C[O-].C[O-]
Calculated Properties
JChem
Acid pKa
15.775593
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-0.51857704
LogD (pH = 7.4)
-0.5185771
Log P
-0.51857704
Molar Refractivity
18.8116
Polarizability
2.9253356
Polar Surface Area
23.06
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
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Molecule Details
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References
Bioactivity
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