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Propane sultone

CAT: 0013-GTR19299525-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19299525-01Size:10 mg
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Description
Propane sultone is a versatile chemical intermediate used in research. Its applications include serving as an electrolyte additive in lithium-ion batteries and as a reagent in the synthesis of dyes and functional materials for textiles. Studies also explore its reactivity in modifying biomolecules for in vitro biochemical research.
CAS Number
1120-71-4
Molecular Weight
122.14
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Propane sultone

1,3-Propane Sultone can cause cancer according to an independent committee of scientific and health experts.

CAS Number1120-71-4
PubChem CID14264
IUPAC Nameoxathiolane 2,2-dioxide
Molecular FormulaC3H6O3S
Molecular Weight122.15
XLogP-0.2
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count7
Formal Charge0
Complexity140
SMILES
C1COS(=O)(=O)C1
InChI
InChI=1S/C3H6O3S/c4-7(5)3-1-2-6-7/h1-3H2
InChIKey
FSSPGSAQUIYDCN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propane sultone
CAS: 1120-71-4
CID: 14264
Formula: C3H6O3S
MW: 122.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight122.15
XLogP3-0.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass122.00376522
Monoisotopic Mass122.00376522
Topological Polar Surface Area51.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity140
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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