6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo(d)oxazole
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Grundinformationen
- CAS
1810038-58-4- Standard-SMILES
CC1(C)OB(c2ccc3ncoc3c2)OC1(C)C- InChIKey
GFKZCRRRPMENIV-UHFFFAOYSA-N- Summenformel
- C13H16BNO3
- Durchschnittliche Molmasse
- 245,08 g/mol
- Monoisotopische Masse
- 245,1223235
Namen und Bezeichner
- Bevorzugter Name
- 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo(d)oxazole
- IUPAC
- 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole
- Englischer Name
- Benzoxazole-6-boronic Acid Pinacol Ester
- Summenformel
- C13H16BNO3
- Molmasse
- 245.08
Namen und Synonyme
1810038-58-46-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazole6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo(d)oxazoleRefChem:539334821-235-26-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazoleMFCD13181969Benzoxazole-6-boronic Acid Pinacol Ester6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazoleSCHEMBL146620766-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoxazoleAC4856
Weitere Namen anzeigen
1,3-benzoxazole-6-boronic acid pinacol esterBenzoxazole, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole - [T83910]
BENZO[D]OXAZOL-6-YLBORONIC ACID PINACOL ESTERBS-427016-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzooxazoleKXC03858MB12483SY129989DB-414330CS-0132502
Datenbank-Bezeichner
- CAS
1810038-58-4- PubChem CID
- 71239848
- EC Number
- 821-235-2
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- Polarare Oberfläche (TPSA)
- 44,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 318
Physikochemische Eigenschaften
- Siedepunkt
- 350.1 · 350.1±15.0 °C(Predicted)
- Dichte
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 1.18 · 1.18±0.30(Predicted)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (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 exposure; Respiratory 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)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315
Chemie und Industrie
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