Molecule

ID:127081

General Information
Structure
MolImage
Molecular Formula
C₂H₆O₄S
Molecular Mass
126.13164
Exact Mass
125.99867967
Charge
0
InChI
InChI=1S/C2H6O4S/c1-5-7(3,4)6-2/h1-2H3
InChIKey
VAYGXNSJCAHWJZ-UHFFFAOYSA-N
Canonic Smiles
COS(=O)(=O)OC
Isomeric Smiles
COS(=O)(=O)OC
Calculated Properties
JChem
LogD (pH = 7.4)
-0.09
LogD (pH = 5.5)
-0.09
Log P
-0.09
Rotatable Bonds
2
H Donor
0
H Acceptors
2
Lipinski's Rule of Five
true
Polar Surface Area
52.60
Polarizability
10.47
Molar Refractivity
22.74
LOG S
0.22
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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