HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
p-iodobenzolsulfonylchlorid
P-IODOBENZENESULFONYL CHLORIDE · PIPSYL CHLORIDE · 4-IodobenzenesuL · Pipsyl chloride,97% · 4-Iodo-benzenesulfonyl · Pipsyl chloride, 97% 5GR · 4-IODOPHENYLSULFONYL CHLORIDE · 4-Jodobenzenesulfonylchloride
Identifikatoren & physikalische Daten
| CAS No. | 98-61-3 |
|---|---|
| Summenformel | C6H4ClIO2S |
| Durchschnittliche Molmasse | 302,52 g/mol |
| Monoisotopische Masse | 301,86652605 g/mol |
| SMILES | O=S(=O)(Cl)c1ccc(I)cc1 |
| InChIKey | POXFXTSTVWDWIR-UHFFFAOYSA-N |
| PubChem CID | 7399 |
| EC No. | 202-686-9 |
| DTXSID | DTXSID9059175 |
| Lokaler Name | p-iodobenzolsulfonylchlorid |
Chemische & physikalische Eigenschaften
| XLogP | 3 |
|---|---|
| Polarare Oberfläche (TPSA) | 42,5 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 213 |
| SpringerMaterials Properties | Nuclear quadrupole resonance spectroscopy |
| Schmelzpunkt | 80-82 °C (lit.) |
| Siedepunkt | 319.1±25.0 °C(Predicted) |
| Dichte | 1.999 (estimate) |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2–8 °C |
| Löslichkeit | ethanol: soluble100mg/mL, clear to slightly hazy, colorless to yellowReacts with water. |
| Aggregatzustand | Crystals or Crystalline Powder |
| Farbe | White to beige or orange |
| Merck | 14,7486 |
| BRN | 2691661 |
| InChI | 1S/C6H4ClIO2S/c7-11(9,10)6-3-1-5(8)2-4-6/h1-4H |
| InChIKey | POXFXTSTVWDWIR-UHFFFAOYSA-N |
| SMILES | ClS(=O)(=O)c1ccc(I)cc1 |
| CAS Datenbank | 98-61-3(CAS DataBase Reference) |
| EPA chemische Informationen | Benzenesulfonyl chloride, 4-iodo- (98-61-3) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, 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. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Corr. 1B (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 3261 8/PG 2 |
| Zollcode | 29049020 |
| R-Sätze (R) | 34 |
| Gefahrensymbole | C |
| Sicherheitshinweise (S) | 26-27-36/37/39-45-28A |
| Gefahrenklasse | 8Eye Dam. 1Skin Corr. 1B |
| Verpackungsgruppe | II |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
Anwendungen & Verwendung
Verwenden
It is used as intermediate in organic syntheses & in medicine.