Allyl methyl sulfone
Product Information
Molecular Formula
C4H8O2S
Molecular Weight
120.17
Description
Allyl methyl sulfone is a sulfone.
Synonyms
3-(Methylsulfonyl)-1-propene, MAS
IUPAC Name
3-methylsulfonylprop-1-ene
SMILES
CS(=O)(=O)CC=C
InChI
InChI=1S/C4H8O2S/c1-3-4-7(2,5)6/h3H,1,4H2,2H3
InChI Key
WOPDMJYIAAXDMN-UHFFFAOYSA-N
Flash Point
Not applicable
Purity
0.96
Density
1.171 g/mL at 25 °C
Refractive Index
n20/D 1.472
Safety Information
Hazards
H317
Precautionary Statement
P280
Computed Properties
XLogP3
0.2
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
120.02450067 g/mol
Monoisotopic Mass
120.02450067 g/mol
Topological Polar Surface Area
42.5Ų
Heavy Atom Count
7
Formal Charge
0
Complexity
138
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113131000-A | Carbonate electrolyte and metal lithium battery | 2021-04-19 |
| CN-112972454-A | Application of allicin in preparation of product for preventing or treating hereditary cardiomyopathy | 2021-03-10 |
| WO-2022046174-A1 | Epoxy modified additives for lithium ion batteries | 2020-08-27 |
| US-2022045359-A1 | Mechanically robust solid electrolyte compositions for alkali and beyond alkali metal batteries | 2020-08-10 |
| WO-2022035468-A1 | Unsaturated additive for lithium ion battery | 2020-08-10 |
| JP-2022016004-A | Polar group-containing olefin copolymer | 2020-07-10 |
| US-2021376382-A1 | Lithium ion battery electrolyte additive | 2020-06-01 |
| WO-2021247513-A1 | Lithium ion battery electrolyte additive | 2020-06-01 |
| US-2021376386-A1 | Modified ionic liquids containing bicyclophosphate moiety | 2020-05-27 |
| WO-2021257242-A2 | Modified ionic liquids containing bicyclophosphate moiety | 2020-05-27 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 12593760 | 2002-12-01 | In vivo metabolism of diallyl disulphide in the rat: identification of two new metabolites | Xenobiotica; the fate of foreign compounds in biological systems |
