HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Chloro-4-isopropoxyphenylboronic acid
3-Chloro-4-isopropoxybenzeneboronic acid · [3-chloro-4-(propan-2-yloxy)phenyl]boronic acid · 3-Chloro-4-(1-methylethyl)oxyphenylboronic acid · (3-Chloro-4-isopropoxyphenyl)boronic acid - [C2206] · Boronic acid, B-[3-chloro-4-(1-methylethoxy)phenyl]- · Boronic acid, [3-chloro-4-(1-methylethoxy)phenyl]- (9CI)
Identifikatoren & physikalische Daten
| CAS No. | 480438-56-0 |
|---|---|
| Summenformel | C9H12BClO3 |
| Durchschnittliche Molmasse | 214,457 g/mol |
| Monoisotopische Masse | 214,05680232 g/mol |
| SMILES | CC(C)Oc1ccc(B(O)O)cc1Cl |
| InChIKey | PJBWTULFEPFOEB-UHFFFAOYSA-N |
| PubChem CID | 3382467 |
| EC No. | 895-319-2 |
| DTXSID | DTXSID40391969 |
Chemische & physikalische Eigenschaften
| Schmelzpunkt | 140-145 °C(lit.) |
|---|---|
| Siedepunkt | 357.1±52.0 °C(Predicted) |
| Dichte | 1.23±0.1 g/cm3(Predicted) |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| pKa (Säurekonstante) | 7.75±0.18(Predicted) |
| InChI | InChI=1S/C9H12BClO3/c1-6(2)14-9-4-3-7(10(12)13)5-8(9)11/h3-6,12-13H,1-2H3 |
| InChIKey | PJBWTULFEPFOEB-UHFFFAOYSA-N |
| SMILES | B(C1=CC=C(OC(C)C)C(Cl)=C1)(O)O |
Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | 3 |
|---|---|
| Zollcode | 2931900090 |
Anwendungen & Verwendung
Verwenden
Reactant for:• ;Preparation of alkyl- and aryl quinones via silver nitrate-catalyzed coupling with quinones1• ;Rhodium-catalyzed asymmetric arylation of alkenylheterocycles2• ;Stereoselective and regioselective rhodium-catalyzed carbometalation of ynamides3