HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Isopropyl-2-furoat
Ai3-23589 · Nsc 35576 · Einecs 228-451-0 · Isopropyl furoate · isopropyl 2-furoate · Isopropyl 2-Furoate (~90%) · Isopropyl furan-2-carboxylate · 2-Furoic acid, isopropyl ester
Identifikatoren & physikalische Daten
| CAS No. | 6270-34-4 |
|---|---|
| Summenformel | C8H10O3 |
| Durchschnittliche Molmasse | 154,16 g/mol |
| Monoisotopische Masse | 154,06299418 g/mol |
| SMILES | CC(C)OC(=O)c1ccco1 |
| InChIKey | IIISLCMALFIFKE-UHFFFAOYSA-N |
| PubChem CID | 80452 |
| EC No. | 228-451-0 |
| DTXSID | DTXSID3064190 |
| Lokaler Name | Isopropyl-2-furoat |
Chemische & physikalische Eigenschaften
| XLogP | 1,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 39,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 142 |
| SpringerMaterials Properties | Optical coefficient |
| Siedepunkt | 198.5°C (estimate) |
| Dichte | 1.0655 |
| Brechungsindex | 1.4682 (estimate) |
| Lagerbedingungen | Refrigerator, under inert atmosphere |
| Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
| Aggregatzustand | Oil |
| Farbe | Yellow |
| LogP (Verteilungskoeffizient) | 1.965 (est) |
| CAS Datenbank | 6270-34-4 |
| EPA chemische Informationen | 2-Furancarboxylic acid, 1-methylethyl ester (6270-34-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH227 (100%): Combustible liquid [Warning Flammable liquids]P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 4 (100%) |
| TSCA-Inventar-Status | TSCA listed |
Anwendungen & Verwendung
Verwenden
Isopropyl 2-Furoate is used in the preparation of heteroarenecarboxylates.