Molecule

ID:32211

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀O₃S
Molecular Mass
138.1854
Exact Mass
138.03506518
Charge
0
InChI
InChI=1S/C4H10O3S/c1-8(6,7)4-2-3-5/h5H,2-4H2,1H3
InChIKey
XPXXXQZNUQAFQY-UHFFFAOYSA-N
Canonic Smiles
OCCCS(=O)(=O)C
Isomeric Smiles
S(=O)(=O)(CCCO)C
Calculated Properties
JChem
Acid pKa
15.930193
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-1.7789248
LogD (pH = 7.4)
-1.7789248
Log P
-1.7789248
Molar Refractivity
31.6077
Polarizability
12.983135
Polar Surface Area
54.37
Rotatable Bonds
3
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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