| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 63438-80-2 |
| ECHA EC Number: | 264-144-8 |
| FDA UNII: | Search |
| Category: | indirect food additives: adhesives and components of coatings |
| IUPAC Name: | (2-carbobutoxyethyl)tin-tris(isooctyl mercaptoacetate) |
| InChI : | InChI=1/3C10H20O2S.C7H13O2.Sn/c3*1-9(2)6-4-3-5-7-12-10(11)8-13;1-3-5-6-9-7(8)4-2;/h3*9,13H,3-8H2,1-2H3;2-6H2,1H3;/q;;;;+3/p-3 |
| Std.InChI: | InChI=1S/3C10H20O2S.C7H13O2.Sn/c3*1-9(2)6-4-3-5-7-12-10(11)8-13;1-3-5-6-9-7(8)4-2;/h3*9,13H,3-8H2,1-2H3;2-6H2,1H3;/q;;;;+3/p-3 |
| InChIKey : | UTRJILPAPGNYRR-DFZHHIFOAA |
| Std.InChIKey: | NAXJREFTBAJZEM-UHFFFAOYSA-K |
| SMILES : | CCCCOC(=O)CC[Sn](SCC(=O)OCCCCCC(C)C)(SCC(=O)OCCCCCC(C)C)SCC(=O)OCCCCCC(C)C |
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| FDA/DG SANTE Petitions, Reviews, Notices: | |
| GRN 13 | Botanicals: Chrysanthemum; Licorice; Jellywort AND Honeysuckle; Lophatherum; Mulberry leaf; Frangipani; Selfheal; Sophora flower bud View - notice PDF |
| DG SANTE Food Contact Materials: | (2-carbobutoxyethyl)tin-tris(isooctyl mercaptoacetate) |
| FDA Mainterm (IAUFC): | 63438-80-2 ; BETA-CARBOBUTOXYETHYLTIN TRIS(ISOOCTYL MERCAPTOACETATE) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Soluble in: | |
| water, 6.65e-011 mg/L @ 25 °C (est) | |
| None found |
| None found |
| 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: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| indirect food additives: adhesives and components of coatings | |||
| Recommendation for (2-carbobutoxyethyl)tin-tris(isooctyl mercaptoacetate) usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for (2-carbobutoxyethyl)tin-tris(isooctyl mercaptoacetate) flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| EPA Substance Registry Services (TSCA):63438-80-2 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :113194 |
| National Institute of Allergy and Infectious Diseases:Data |
| butyl 3-tris[[2-(6-methylheptoxy)-2-oxoethyl]sulfanyl]stannylpropanoate |
| Chemidplus:0063438802 |
| butyl 3-tris[[2-(6-methylheptoxy)-2-oxoethyl]sulfanyl]stannylpropanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 113194 |
| Pubchem (sid): | 135071121 |
| (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 |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
| None Found |
| None Found |
| not found in nature |
| butyl 3-(tris((2-(isooctyloxy)-2-oxoethyl)thio)stannyl)propionate | |
| butyl 3-tris[[2-(6-methylheptoxy)-2-oxoethyl]sulfanyl]stannylpropanoate | |
| propanoic acid, 3-(tris((2-(isooctyloxy)-2-oxoethyl)thio)stannyl)-, butyl ester |
