Record Information |
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Version | 1.0 |
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Creation date | 2018-05-02 12:11:20 UTC |
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Update date | 2018-05-04 14:23:54 UTC |
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FoodComEx ID | PC001182 |
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FoodDB Record | FDB006725 |
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Chemical Information |
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Name | Dimethyl sulfone |
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Description | Dimethyl sulfone (DMSO2), also known as sulfonylbismethane, belongs to the class of organic compounds known as sulfones. Sulfones are compounds containing a sulfonyl group, with the general structure RS(=O)2R' (R,R' =alkyl, aryl). It occurs naturally in some primitive plants and is present in small amounts in many foods and beverages and it is marketed as a dietary supplement. This colorless solid features a sulfonyl functional group and is considered relatively inert chemically. Dimethyl sulfone reflects its close chemical relationship to dimethyl sulfoxide (DMSO), which differs only in the oxidation state of the sulfur atom. Dimethyl sulfone is the primary metabolite of DMSO in humans, and it shares some of the properties of DMSO. Dimethyl sulfone is a metabolite occurring in plasma and cerebrospinal fluid of normal humans. It derives from dietary sources, from intestinal bacterial metabolism and from human endogenous methanethiol metabolism (PMID: 15996001). It is sometimes used as a cutting agent for illicitly manufactured methamphetamine. Because of its polarity and thermal stability, Dimethyl sulfone is used industrially as a high-temperature solvent for both inorganic and organic substances. Dimethyl sulfone is also commonly found in the atmosphere above marine areas, where it is used as a carbon source by the airborne bacteria Afipia (PMID: 23359712). |
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CAS Number | 67-71-0 |
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Structure | |
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Synonyms | Synonym | Source |
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(Methylsulfonyl)methane | HMDB | Dimethyl sulfone | biospider | Dimethyl sulphone | biospider | Dimethylsulfone | biospider | DMSO2 | manual | Lignisul msm | HMDB | Methane, 1,1'-sulfonylbis- | biospider | Methane, sulfonylbis- | biospider | Methyl sulfone | biospider | Methylsulfonyl methane | biospider | Methylsulfonylmethane | biospider | Methylsulphonylmethane | Generator | MSM | biospider | Opti msm | HMDB | Sulfone, dimethyl- | biospider | Sulfonylbis-methane | HMDB | Sulfonylbismethane | biospider | Sulfonyldimethane | biospider | Sulphonylbismethane | biospider |
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Chemical Formula | C2H6O2S |
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IUPAC name | methanesulfonylmethane |
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InChI Identifier | InChI=1S/C2H6O2S/c1-5(2,3)4/h1-2H3 |
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InChI Key | HHVIBTZHLRERCL-UHFFFAOYSA-N |
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Isomeric SMILES | CS(C)(=O)=O |
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Average Molecular Weight | 94.133 |
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Monoisotopic Molecular Weight | 94.008850126 |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as sulfones. Sulfones are compounds containing a sulfonyl group( which as the general structure RS(=O)2R' (R,R' =alkyl, aryl)) attached to two carbon atoms. |
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Kingdom | Organic compounds |
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Super Class | Organosulfur compounds |
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Class | Sulfonyls |
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Sub Class | Sulfones |
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Direct Parent | Sulfones |
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Alternative Parents | |
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Substituents | - Sulfone
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | |
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Physico-Chemical Properties - Experimental |
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Property | Value | Reference |
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Experimental logP | -1.41 | HANSCH,C ET AL. (1995) |
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Experimental Water Solubility | Not Available | |
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Melting Point | 109 oC | |
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Foods of Origin |
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Food | Content Range | Average | Reference |
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Food | | | Reference |
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Production Data |
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Production Method | commercial |
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Production Method Reference | Not Available |
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Production Method Reference File | Not Available |
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Quantity Available | 1 to 2 mg |
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Delivery Time | 2 weeks |
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Storage Form | powder |
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Storage Conditions | -18°C |
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Stability | Not Available |
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Purity | unknown |
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Spectra |
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Spectral Data Upon Request | Not Available |
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Provider Information |
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Contact Name | Contact Institution | Contact Email |
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Augustin Scalbert | International Agency for Research on Cancer (IARC), Biomarkers Group, 150 cours Albert Thomas, Lyon, FR, 69372 | scalberta@iarc.fr |
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Commercial Vendors |
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AKSci | Y5828 |
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MetaSci | HMDB0004983 |
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Sigma-Aldrich | HMDB0004983 |
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Toronto Research Chemicals | D479350 |
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