| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 1115-84-0 |
| ECHA EC Number: | 214-231-1 |
| FDA UNII: | G9CUR2204U |
| Category: | antioxidants and preservatives for fragrance and flavor |
| IUPAC Name: | S-methyl methioninium chloride |
| InChI : | InChI=1/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H/t5-;/m0./s1 |
| Std.InChI: | InChI=1S/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H/t5-;/m0./s1 |
| InChIKey : | MYGVPKMVGSXPCQ-JEDNCBNOBC |
| Std.InChIKey: | MYGVPKMVGSXPCQ-JEDNCBNOSA-N |
| SMILES : | C[S+](C)CC[C@@H](C(=O)O)N.[Cl-] |
| Appearance: | white crystalline powder (est) |
| Assay: | 98.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 134.00 to 139.00 °C. @ 760.00 mm Hg |
| Flash Point: | 32.00 °F. TCC ( 0.00 °C. ) (est) |
| logP (o/w): | 0.280 |
| Soluble in: | |
| alcohol | |
| water | |
| water, 215.8 mg/L @ 25 °C (est) | |
| None found |
| American International Chemical, LLC. |
| Vitamin U |
| Augustus Oils |
| Dimethyl Methionine Sulph Chl |
| Services |
| BOC Sciences |
| For experimental / research use only. |
| L-Methionine S-methylsulfonium chloride 95% |
| Carbosynth |
| For experimental / research use only. |
| L-Methionine-S-methyl sulfonium chloride |
| M&U International |
| Vitamin U, Kosher |
| Synerzine |
| Vitamine U Chloride |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| oral-mouse LD50 > 6000 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. intravenous-mouse LD50 259 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. intravenous-rat LD50 432 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. oral-rat LD50 > 6000 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. | |
| Dermal Toxicity: | |
| subcutaneous-mouse LD50 > 6000 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. subcutaneous-rat LD50 > 6000 mg/kg Drugs in Japan Vol. 6, Pg. 835, 1982. | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| antioxidants and preservatives for fragrance and flavor | |||
| Recommendation for S-methyl methioninium chloride usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for S-methyl methioninium chloride flavor usage levels up to: | |||
| not for flavor use. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 350.00 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 75.00 (μg/capita/day) | ||
| Structure Class: | III | ||
| European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): |
| Flavouring Group Evaluation 79, (FGE.79)[1] - Consideration of amino acids and related substances evaluated by JECFA (63rd meeting) structurally related to amino acids from chemical group 34 evaluated by EFSA in FGE.26Rev1 (2008) View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 96 (FGE.96): Consideration of 88 flavouring substances considered by EFSA for which EU production volumes / anticipated production volumes have been submitted on request by DG SANCO. Addendum to FGE. 51, 52, 53, 54, 56, 58, 61, 62, 63, 64, 68, 69, 70, 71, 73, 76, 77, 79, 80, 83, 84, 85 and 87. View page or View pdf |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):1115-84-0 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :16217806 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| [(3S)-3-amino-3-carboxypropyl](dimethyl)sulfonium chloride |
| Chemidplus:0001115840 |
| [(3S)-3-amino-3-carboxypropyl](dimethyl)sulfonium chloride | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 1115-84-0 |
| Pubchem (cid): | 16217806 |
| Pubchem (sid): | 134979450 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Indirect Additives used in Food Contact Substances: | View |
| CHEBI: | View |
| CHEMBL: | View |
| KEGG (GenomeNet): | C04078 |
| HMDB (The Human Metabolome Database): | Search |
| FooDB: | FDB018071 |
| Export Tariff Code: | 2936.90.0000 |
| FDA Listing of Food Additive Status: | View |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| (S)-(3- | amino-3-carboxypropyl) dimethyl sulfonium chloride |
| laevo-(3- | amino-3-carboxypropyl) dimethyl sulfonium chloride |
| laevo-(S)-(3- | amino-3-carboxypropyl) dimethyl sulfonium chloride |
| L-(3- | amino-3-carboxypropyl)dimethylsulfonium chloride |
| L-(3- | amino-4-hydroxy-4-oxobutyl)-dimethylsulfanium chloride |
| laevo-(3- | amino-4-hydroxy-4-oxobutyl)-dimethylsulfanium chloride |
| ardesyl | |
| cabagin | |
| epadyn-U | |
| merastom | |
| laevo- | methyl methionine sulfonum chloride |
| S- | methylmethionine |
| L- | methylmethioninesulfonum chloride |
| L- | methylmethioninesulphonium chloride |
| S- | methylmethioninesulphonium chloride |
| S- | methylmethioninium chloride |
| S- | methymethionine chloride |
| u-vit | |
| vitamin U | |
| yucron | |
| [(3S)-3- | amino-3-carboxypropyl](dimethyl)sulfonium chloride |
