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2-Chloro-4-fluoro-1-iodobenzene
2-CHLORO-4-FLUORO-1-IODOBENZENE · colorless liquid · 2-Chloro-4-fluoroiodo · 2-Chloro-4-fluoroiodobenzene · 3-Chloro-4-iodofluorobenzene · 4-Fluoro-2-chloroiodobenzene · 3-Chloro-1-fluoro-4-iodobenzene · 2-Chloro-4-fluoroiodobenzene98%
Identifikatoren & physikalische Daten
| CAS No. | 101335-11-9 |
|---|---|
| Summenformel | C6H3ClFI |
| Durchschnittliche Molmasse | 256,44 g/mol |
| Monoisotopische Masse | 255,895204 g/mol |
| SMILES | Fc1ccc(I)c(Cl)c1 |
| InChIKey | POTCKVPDYXEGSV-UHFFFAOYSA-N |
| PubChem CID | 2736559 |
| EC No. | 600-191-6 |
| DTXSID | DTXSID20371441 |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 99,1 |
| Siedepunkt | 96 °C |
| Dichte | 2.008±0.06 g/cm3(Predicted) |
| Brechungsindex | 1.601 |
| Flammpunkt | 96-98°C/15mm |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Aggregatzustand | liquid |
| Farbe | Clear, colourless |
| BRN | 2435080 |
| InChI | 1S/C6H3ClFI/c7-5-3-4(8)1-2-6(5)9/h1-3H |
| InChIKey | POTCKVPDYXEGSV-UHFFFAOYSA-N |
| SMILES | Fc1ccc(I)c(Cl)c1 |
| CAS Datenbank | 101335-11-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 3 (14.3%) |
| Wassergefährdungsklasse (WGK) | WGK 3 |
| Zollcode | 2903998090 |
| R-Sätze (R) | 36/37/38-22-36 |
| Gefahrensymbole | Xi,Xn |
| Sicherheitshinweise (S) | 26-36/37/39-23 |
| Gefahrenklasse | IRRITANTAcute Tox. 3 OralEye Irrit. 2 |
| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
Anwendungen & Verwendung
Verwenden
2-Chloro-4-fluoroiodobenzene is a polyhalogenated benzene derivative containing reactive substituents such as fluorine, bromine and iodine atoms in its structure. It can be used as a raw material for the preparation of organic synthesis for the preparation of other organic heterocyclic compounds. It can also be used as a key intermediate component in the manufacture of pharmaceuticals.