HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Iodobenzaldehyde
o-Iodobenzaldehyde · 2-IODOBENZALDEHYDE · Benzaldehyde, 2-iodo- · 2-Iodobenzaldehyde 97% · 2-Iodobenzaldehyde,98% · 2-Iodobenzaldehyde o-Iodobenzaldehyde
Identifikatoren & physikalische Daten
| CAS No. | 26260-02-6 |
|---|---|
| Summenformel | C7H5IO |
| Durchschnittliche Molmasse | 232,02 g/mol |
| Monoisotopische Masse | 231,93851278 g/mol |
| SMILES | O=Cc1ccccc1I |
| InChIKey | WWKKTHALZAYYAI-UHFFFAOYSA-N |
| PubChem CID | 643439 |
| EC No. | 607-898-9 |
| DTXSID | DTXSID40180895 |
Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 17,1 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 9 |
| Formalladung | 0 |
| Komplexität | 103 |
| Schmelzpunkt | 36-39 °C (lit.) |
| Siedepunkt | 129 °C (14 mmHg) |
| Dichte | 1.8576 (estimate) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | soluble in Methanol |
| Aggregatzustand | Low Melting Crystalline Mass or Powder |
| Farbe | White to light beige |
| BRN | 1927296 |
| InChI | InChI=1S/C7H5IO/c8-7-4-2-1-3-6(7)5-9/h1-5H |
| InChIKey | WWKKTHALZAYYAI-UHFFFAOYSA-N |
| SMILES | C(=O)C1=CC=CC=C1I |
| CAS Datenbank | 26260-02-6(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 45 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 Irrit. 2 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29130000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36-37/39 |
| Gefahrenklasse | IRRITANT, AIR SENSITIVE, KEEP COLDEye Irrit. 2Skin Irrit. 2STOT SE 3 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
2-Iodobenzaldehyde may be used as a reactant in the synthesis of the following heterocycles:2,3-diaryl-1-indenonesindolo[1,2-a]quinazolinesBaylis-Hillman (BH) adductsIt may also be used in preparing:5-phenylindazolo[3,2-b]quinazolin-7(5H)-one4-(3-iodophenyl)-2,2:6,2-terpyridinefluoren-9-one2-formyl-3′-methoxybiphenyl