HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Acetoxyisobutyroylchlorid
2-ACETOXYISOBUTYRYL CHLORIDE · 2-Acetoxy-2-methylpropanoyl chloride · SKL1299 · 1-Chlorocarbonyl-1-m · 2-acetyl chloride oxy iso · 2-acetoxyisobutyl chloride · 2-ACETOXYLISOBUTYRYL BROMIDE · 2-acetoxyisobutyroyl chloride
Identifikatoren & physikalische Daten
| CAS No. | 40635-66-3 |
|---|---|
| Summenformel | C6H9ClO3 |
| Durchschnittliche Molmasse | 164,59 g/mol |
| Monoisotopische Masse | 164,02402183 g/mol |
| SMILES | CC(=O)OC(C)(C)C(=O)Cl |
| InChIKey | RBTCRFLJLUNCLL-UHFFFAOYSA-N |
| PubChem CID | 123496 |
| EC No. | 255-016-2 |
| DTXSID | DTXSID80193641 |
| Lokaler Name | 2-Acetoxyisobutyroylchlorid |
Chemische & physikalische Eigenschaften
| XLogP | 1,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 43,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 162 |
| Siedepunkt | 55-56 °C/6 mmHg (lit.) |
| Dichte | 1.136 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.428(lit.) |
| Flammpunkt | 155 °F |
| Lagerbedingungen | Inert atmosphere,2-8°C |
| Löslichkeit | Acetonitrile (Slightly), Chloroform (Slightly) |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light yellow |
| BRN | 507772 |
| InChI | 1S/C6H9ClO3/c1-4(8)10-6(2,3)5(7)9/h1-3H3 |
| InChIKey | RBTCRFLJLUNCLL-UHFFFAOYSA-N |
| SMILES | CC(=O)OC(C)(C)C(Cl)=O |
| CAS Datenbank | 40635-66-3(CAS DataBase Reference) |
| NIST chemische Informationen | 2-Acetoxyisobutyryl chloride(40635-66-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Skin Corr. 1B (100%) |
| F | 10-21 |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 3265 8/PG 2 |
| Zollcode | 29189990 |
| R-Sätze (R) | 14-34 |
| Gefahrensymbole | C |
| Sicherheitshinweise (S) | 26-36/37/39-45 |
| Gefahrenklasse | 8Skin Corr. 1B |
| Verpackungsgruppe | III |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
Anwendungen & Verwendung
Verwenden
1-Chlorocarbonyl-1-methylethyl acetate was used in preparation of α,γ-dichloro alditols.