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2-Chlorbenzolsulfonylchlorid
2-CHLOROBENZENES · BUTTPARK 37\11-76 · o-chlorobenzenesulfochloride · o-chloro-benzenesulfonylchlorid · 2-chloro-benzenesulfonylchlorid · 2-Chlorophenylsulfonyl Chloride · o-chlorobenzenesulfonyl chloride · 2-Chlorobenxenesulfonyl Chloride
Identifikatoren & physikalische Daten
| CAS No. | 2905-23-9 |
|---|---|
| Summenformel | C6H4Cl2O2S |
| Durchschnittliche Molmasse | 211,06 g/mol |
| Monoisotopische Masse | 209,93090573 g/mol |
| SMILES | O=S(=O)(Cl)c1ccccc1Cl |
| InChIKey | KMVZDSQHLDGKGV-UHFFFAOYSA-N |
| PubChem CID | 76187 |
| EC No. | 220-807-3 |
| DTXSID | DTXSID3074731 |
| Lokaler Name | 2-Chlorbenzolsulfonylchlorid |
Chemische & physikalische Eigenschaften
| XLogP | 2,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 42,5 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 219 |
| Schmelzpunkt | 26-28℃ |
| Siedepunkt | 150-152 °C/12 mmHg (lit.) |
| Dichte | 1.548 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.576(lit.) |
| Flammpunkt | 140 °F |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| Aggregatzustand | Liquid or Low Melting Solid |
| Farbe | Clear yellow to orange-red |
| Löslichkeit | It reacts with water. |
| BRN | 974321 |
| InChI | 1S/C6H4Cl2O2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H |
| InChIKey | KMVZDSQHLDGKGV-UHFFFAOYSA-N |
| SMILES | Clc1ccccc1S(Cl)(=O)=O |
| CAS Datenbank | 2905-23-9(CAS DataBase Reference) |
| NIST chemische Informationen | 2-Chlorobenzenesulfonyl chloride(2905-23-9) |
| EPA chemische Informationen | Benzenesulfonyl chloride, 2-chloro- (2905-23-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH226 (89.6%): Flammable liquid and vapor [Warning 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 48 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance. |
| Hazard Classes and Categories | Flam. Liq. 3 (89.6%) |
| Wassergefährdungsklasse (WGK) | 2 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 2920 8/PG 2 |
| Zollcode | 29049090 |
| RTECS-Nr. | DB8925500 |
| R-Sätze (R) | 34 |
| Gefahrensymbole | C |
| hazard_note | Corrosive |
| Sicherheitshinweise (S) | 26-36/37/39-45 |
| Gefahrenklasse | 8Flam. Liq. 3Skin Corr. 1B |
| Verpackungsgruppe | II |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
2-Chlorobenzenesulfonyl chloride is used as an organic chemical synthesis intermediate.