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1,2-Difluorbenzol
difluorobenzene · O-DIFLUOROBENZENE · o-DFB · 1,2-DifL · NSC 10275 · 2-Difluorobenzene · 1,2-Difluorbenzol · o-difluoro-benzen
Identifikatoren & physikalische Daten
| CAS No. | 367-11-3 |
|---|---|
| Summenformel | C6H4F2 |
| Durchschnittliche Molmasse | 114,09 g/mol |
| Monoisotopische Masse | 114,02810657 g/mol |
| SMILES | Fc1ccccc1F |
| InChIKey | GOYDNIKZWGIXJT-UHFFFAOYSA-N |
| PubChem CID | 9706 |
| ChEBI | CHEBI:38583 |
| EC No. | 206-680-7 |
| DTXSID | DTXSID2075390 |
| Lokaler Name | 1,2-Difluorbenzol |
Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 62,9 |
| Stoffklassen | Other Classes -> Halogenated Monoaromatics |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| LogP (Verteilungskoeffizient) | 2.1 |
| Physical Description | Colorless liquidNot miscible or difficult to mix in water[MSDSonline] |
| Schmelzpunkt | −34 °C(lit.) |
| Siedepunkt | 92 °C(lit.) |
| Dichte | 1.158 g/mL at 25 °C(lit.) |
| Brechungsindex | n20/D 1.443(lit.) |
| Flammpunkt | 36 °F |
| Lagerbedingungen | Flammables area |
| Löslichkeit | Chloroform, MethanolNot miscible or difficult to mix in water. |
| Aggregatzustand | Liquid |
| Wichte | 1.158 |
| Farbe | Clear colorless |
| Spezifische Wärmekapazität | Cp(liquid): 1.39 J/(g·K), at 25℃ |
| BRN | 1905113 |
| Henry-Konstante | 1.3×10-3 mol/(m3Pa) at 25℃, Brockbank (2013) |
| Dielektrizitätskonstante | 14.26 |
| Stabilität | Stable. Incompatible with strong oxidizing agents. Highly flammable. Note low flash point. |
| InChI | 1S/C6H4F2/c7-5-3-1-2-4-6(5)8/h1-4H |
| InChIKey | GOYDNIKZWGIXJT-UHFFFAOYSA-N |
| SMILES | Fc1ccccc1F |
| CAS Datenbank | 367-11-3(CAS DataBase Reference) |
| NIST chemische Informationen | Benzene, 1,2-difluoro-(367-11-3) |
| EPA chemische Informationen | Benzene, 1,2-difluoro- (367-11-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 0.9% (1 of 109) of reports.DangerH225 (98.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 109 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Gefahrenübersicht | An irritant[MSDSonline] See o-Dichlorobenzene. |
| Hazard Classes and Categories | Flam. Liq. 2 (98.2%) |
| Toxicity Data | LC50 (mice) = 55,000 mg/m3/2h |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 1993 3/PG 2 |
| Zollcode | 29036990 |
| RTECS-Nr. | CZ5655000 |
| R-Sätze (R) | 11-20-2017/11/20 |
| Gefahrensymbole | F,Xn |
| hazard_note | Flammable |
| Sicherheitshinweise (S) | 7-16-29-33-7/9 |
| Gefahrenklasse | 3Flam. Liq. 2 |
| Verpackungsgruppe | II |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
1,2-Difluorobenzene is used in electrochemical analysis of transition metal complexes. 1,2-difluorobenzene is also a potent inhibitor of NMDA receptor.