HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
(4-Fluoro-3-methylphenyl)boronic acid
AKOS BRN-0103 · RARECHEM AH PB 0182 · CHEMBRDG-BB 4003300 · 5-Borono-2-fluorotoluene · 4-FLUORO-M-TOLYLBORONIC ACID · 4-Fluoro-3-methylphenylboronicaci · 3-METHYL-4-FLUOROPHENYLBORONIC ACID · 4-FLUORO-3-METHYLPHENYLBORONIC ACID
Identifikatoren & physikalische Daten
| CAS No. | 139911-27-6 |
|---|---|
| Summenformel | C7H8BFO2 |
| Durchschnittliche Molmasse | 153,95 g/mol |
| Monoisotopische Masse | 154,06013812 g/mol |
| SMILES | Cc1cc(B(O)O)ccc1F |
| InChIKey | JCIJCHSRVPSOML-UHFFFAOYSA-N |
| PubChem CID | 2774580 |
| EC No. | 640-290-1 |
| DTXSID | DTXSID20379109 |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 40,5 |
|---|---|
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 132 |
| Schmelzpunkt | 212-217 °C (lit.) |
| Siedepunkt | 282.0±50.0 °C(Predicted) |
| Dichte | 1.20±0.1 g/cm3(Predicted) |
| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
| pKa (Säurekonstante) | 8.71±0.10(Predicted) |
| Aggregatzustand | Crystalline Powder |
| Farbe | White to off-white |
| BRN | 7474834 |
| InChI | 1S/C7H8BFO2/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4,10-11H,1H3 |
| InChIKey | JCIJCHSRVPSOML-UHFFFAOYSA-N |
| SMILES | Cc1cc(ccc1F)B(O)O |
| CAS Datenbank | 139911-27-6(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, 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 10 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 (20%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29319090 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26-36/37/39-27-37/39 |
| Gefahrenklasse | IRRITANT |
| Lagerklasse | 13 - Non Combustible Solids |
Anwendungen & Verwendung
Verwenden
suzuki reaction