HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Fluoro-4-iodoaniline
uoro-4-iodoaniL · 2-Fluor-4-Iodanilin · 2-fluo-4-iodoaniline · 2-Fluoro-4-iodoanili · 2-fluro-4-iodoaniline · 2-FLUORO-4-IODOANILINE · 4-iodo-2-fluoroaniline · 2-Fluoro-4-idioaniline
Identifikatoren & physikalische Daten
| CAS No. | 29632-74-4 |
|---|---|
| Summenformel | C6H5FIN |
| Durchschnittliche Molmasse | 237,01 g/mol |
| Monoisotopische Masse | 236,94507538 g/mol |
| SMILES | Nc1ccc(I)cc1F |
| InChIKey | CUMTUBVTKOYYOU-UHFFFAOYSA-N |
| PubChem CID | 185694 |
| EC No. | 608-384-7 |
| DTXSID | DTXSID50952101 |
Chemische & physikalische Eigenschaften
| XLogP | 2 |
|---|---|
| Polarare Oberfläche (TPSA) | 26 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 99,1 |
| Schmelzpunkt | 55-57 °C (lit.) |
| Siedepunkt | 248.6±25.0 °C(Predicted) |
| Dichte | 2.008±0.06 g/cm3(Predicted) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| Löslichkeit | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)insoluble |
| pKa (Säurekonstante) | 2.41±0.10(Predicted) |
| Aggregatzustand | Powder |
| Farbe | Off-white to brown |
| BRN | 2081100 |
| InChIKey | CUMTUBVTKOYYOU-UHFFFAOYSA-N |
| LogP (Verteilungskoeffizient) | 2.680 (est) |
| CAS Datenbank | 29632-74-4(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (12.5%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | PG3 |
| Zollcode | 29214200 |
| R-Sätze (R) | 36/37/38-20/21/22 |
| Gefahrensymbole | Xi,T,Xn |
| hazard_note | Toxic |
| Sicherheitshinweise (S) | 26-36-37/39-26/37/39 |
| Gefahrenklasse | IRRITANT-HARMFUL, LIGHT SENSITIVE |
Anwendungen & Verwendung
Verwenden
2-Fluoro-4-iodoaniline is widely used in the pharmaceutical, chemical and food industries as a fundamental building block to create a variety of important compounds.