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2,3-Dimethylfuran
2,3-Dimethylfuran · Furagin Impurity 20 · Furan, 2,3-dimethyl- · 2,3-Dimethylfuran>2,3-Dimethylfuran 99% · 2,3-Dimethylfuran 99% · 2,3-Dimethylfuran,99% · 2,3-Dimethylfuran, GC 99% · 2,3-DiMethylfuran, 99% 1GR
Identifikatoren & physikalische Daten
| CAS No. | 14920-89-9 |
|---|---|
| Summenformel | C6H8O |
| Durchschnittliche Molmasse | 96,13 g/mol |
| Monoisotopische Masse | 96,05751488 g/mol |
| SMILES | Cc1ccoc1C |
| InChIKey | FJSKXQVRKZTKSI-UHFFFAOYSA-N |
| PubChem CID | 34337 |
| ChEMBL | CHEMBL108232 |
| EC No. | 249-235-2 |
| DTXSID | DTXSID301027759 |
Chemische & physikalische Eigenschaften
| XLogP | 1,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 13,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 7 |
| Formalladung | 0 |
| Komplexität | 61,2 |
| SpringerMaterials Properties | Optical coefficient |
| Schmelzpunkt | -62.8°C (estimate) |
| Siedepunkt | 42 °C/115 mmHg (lit.) |
| Dichte | 0.91 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.443(lit.) |
| Flammpunkt | 30 °F |
| Lagerbedingungen | Flammables area |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Yellow to Green |
| Wichte | 0.919 |
| Löslichkeit | Insoluble in water. |
| BRN | 104572 |
| InChI | 1S/C6H8O/c1-5-3-4-7-6(5)2/h3-4H,1-2H3 |
| InChIKey | FJSKXQVRKZTKSI-UHFFFAOYSA-N |
| SMILES | Cc1ccoc1C |
| CAS Datenbank | 14920-89-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P317, P321, P330, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 1993 3/PG 2 |
| Zollcode | 29321900 |
| R-Sätze (R) | 11-20/21/22 |
| Gefahrensymbole | F,Xn |
| Sicherheitshinweise (S) | 16-36 |
| Gefahrenklasse | 3Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralFlam. Liq. 2 |
| Verpackungsgruppe | II |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
2,3-Dimethylfuran may be used in the synthesis of 2,9-dioxabicyclo[3.3.1]nonane. Ireland Alcohol was synthesized in from 2,3-dimethylfuran.