HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Fluoro-5-(methoxycarbonyl)benzeneboronic acid
AKOS BRN-0796 · uoro-5-(methoxycarbonyL · METHYL 3-BORONO-4-FLUOROBENZOATE · 2-Fluoro-5-(methoxycarbonyl)benzeneboronic · -Fluoro-5-(methoxycarbonyl)phenylboronic acid · (2-FLUORO-5-METHOXYCARBONYLPHENYL)BORONIC ACID · (2-FLUORO-5-METHOXYCARBONYL)BENZENEBORONIC ACID · Benzoic acid, 3-borono-4-fluoro-, 1-methyl ester
Identifikatoren & physikalische Daten
| CAS No. | 850568-04-6 |
|---|---|
| Summenformel | C8H8BFO4 |
| Durchschnittliche Molmasse | 197,96 g/mol |
| Monoisotopische Masse | 198,0499671 g/mol |
| SMILES | COC(=O)c1ccc(F)c(B(O)O)c1 |
| InChIKey | MSASJWBQVSRTOE-UHFFFAOYSA-N |
| PubChem CID | 23005366 |
| EC No. | 801-968-4 |
| DTXSID | DTXSID10629640 |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 66,8 |
|---|---|
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 5 |
| Frei drehbare Bindungen | 3 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 212 |
| Schmelzpunkt | 210-212 |
| Siedepunkt | 361.0±52.0 °C(Predicted) |
| Dichte | 1.33±0.1 g/cm3(Predicted) |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| pKa (Säurekonstante) | 7.53±0.58(Predicted) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Zollcode | 2931900090 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
Anwendungen & Verwendung
Verwenden
suzuki reaction