HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Oxiranemethanol, 4-methylbenzenesulfonate, (S)-
(S)-GLYCIDYL TOSYLATE · (S)-Oxiran-2-ylMethyl 4-Methylbenzenesulfonate · (S)-Glycidyl · (+)-glycidyltosylate · (2S)-(+)-Glycidyl to · (S)-Glycidil Tosylate · (S)-(+)-GLYCIDYL TOSYLATE · (2S)-(+)-Lucidly tosylate
Identifikatoren & physikalische Daten
| CAS No. | 70987-78-9 |
|---|---|
| Summenformel | C10H12O4S |
| Durchschnittliche Molmasse | 228,27 g/mol |
| Monoisotopische Masse | 228,04563003 g/mol |
| SMILES | Cc1ccc(S(=O)(=O)OC[C@@H]2CO2)cc1 |
| InChIKey | NOQXXYIGRPAZJC-VIFPVBQESA-N |
| PubChem CID | 153296 |
| ChEMBL | CHEMBL1986003 |
| EC No. | 417-210-7 |
| DTXSID | DTXSID601029330 |
Chemische & physikalische Eigenschaften
| XLogP | 1,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 64,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 15 |
| Formalladung | 0 |
| Komplexität | 298 |
| Schmelzpunkt | 46-49 °C(lit.) |
| Siedepunkt | 340.07°C (rough estimate) |
| Dichte | 1.3749 (rough estimate) |
| Brechungsindex | 1.5400 (estimate) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Dioxane (Slightly), DMSO (Slightly), Methanol (Slightly)decomposes |
| Aggregatzustand | Fluffy Powder |
| Farbe | White |
| BRN | 3592143 |
| InChI | InChI=1/C10H12O4S/c1-8-2-4-10(5-3-8)15(11,12)14-7-9-6-13-9/h2-5,9H,6-7H2,1H3/t9-/s3 |
| InChIKey | NOQXXYIGRPAZJC-DJEYLCQNNA-N |
| SMILES | C1(=CC=C(C)C=C1)S(=O)(=O)OC[C@H]1OC1 |&1:12,r| |
| CAS Datenbank | 70987-78-9(CAS DataBase Reference) |
| NIST chemische Informationen | (2S)-glycidyl tosylate(70987-78-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH317: May cause an allergic skin reaction [Warning Sensitization, Skin]H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]H341: Suspected of causing genetic defects [Warning Germ cell mutagenicity]H350: May cause cancer [Danger Carcinogenicity]H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P203, P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P318, P321, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement) |
|---|---|
| Regulatorische Informationen | Hazard Traits - CarcinogenicityAuthoritative List - EC Annex VI CMRs - Cat. 1BReport - if used as a fragrance or flavor ingredientStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/2748 |
| Hazard Classes and Categories | Skin Sens. 1 (66.7%)Eye Dam. 1 (66.7%)Muta. 2 (66.7%)Carc. 1B (66.7%)Aquatic Chronic 2 (66.7%)Skin Sens. 1 (100%)Eye Dam. 1 (100%)Muta. 2 (100%)Carc. 1B (100%)Aquatic Chronic 2 (100%)Carcinogenicity - category 1BGerm cell mutagenicity - category 2Eye damage - category 1Skin sensitisation - category 1Hazardous to the aquatic environment (chronic) - category 2Aquatic Chronic 2 |
| F | 3-10-21 |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 3077 9/PG 3 |
| Zollcode | 29109000 |
| RTECS-Nr. | RR0510050 |
| R-Sätze (R) | 45-41-43-51/53-68 |
| Gefahrensymbole | T,N,Xi |
| Sicherheitshinweise (S) | 53-45-61 |
| Gefahrenklasse | 9Aquatic Chronic 2Carc. 1BEye Dam. 1Muta. 2Skin Sens. 1 |
| Verpackungsgruppe | III |
| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
Anwendungen & Verwendung
Verwenden
(2S)-(+)-Glycidyl tosylate is protected Glycidol, used as an intermediate in the preparation of neurochemicals.