9-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole

HCID 57415695

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Grundinformationen

CAS: 1126522-69-7
Standard-SMILES: CC1(C)OB(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)OC1(C)C
InChIKey: UBASCOPZFCGGAV-UHFFFAOYSA-N
Summenformel: C24H24BNO2
Durchschnittliche Molmasse: 369,3 g/mol
Monoisotopische Masse: 369,19000941

Namen und Bezeichner

Bevorzugter Name: 9-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole
IUPAC: 9-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole
Englischer Name: 9-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole
Summenformel: C24H24BNO2
Molmasse: 369.26

Namen und Synonyme

9-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazoleRefChem:549887806-607-41126522-69-79-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole9-Phenyl-9H-carbazol-3-yl-3-boronic acid pinacol ester9-PHENYL-9H-CARBAZOLE-3-BORONIC ACID PINACOL ESTERMFCD16621140C24H24BNO29-Phenyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-9H-carbazoleSCHEMBL5274383-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-9-phenylcarbazole

Weitere Namen anzeigen

PCZ-B9-Phenyl-3-N-Phenylcarbazol-3-boronic acid pinacol ester9-Phenyl-9H-carbazole-3-boronic acid naphthalene esterN-Phenylcarbazole-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl

4,4,5,5-Tetramethyl-2-(9-phenylcarbazol-3-yl)-1,3,2-dioxaborolane9-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole;3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-9-phenylcarbazole;9-Phenyl-9H-carbazol-3-yl-3-boronic acid pinacol esterAM20020212SCHEMBL29402671SCHEMBL29552630DTXSID50725458UBASCOPZFCGGAV-UHFFFAOYSA-N(9-PHENYL-9H-CARBAZOL-3-YL)BORONIC ACID PINACOL ESTER

Datenbank-Bezeichner

CAS: 1126522-69-7
PubChem CID: 57415695
DTXSID: DTXSID50725458
EC Number: 806-607-4
Nikkaji: J3.477.233I

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 23,4 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 28
Formalladung: 0
Komplexität: 557

Physikochemische Eigenschaften

Schmelzpunkt: 162 to · 162.0 to 166.0 °C
Siedepunkt: 478.3 · 478.3±27.0 °C(Predicted)
Dichte: 1.11 · 1.11
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Löslichkeit: soluble in Toluene
Aggregatzustand: powder to crystal
Farbe: White to Almost white

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, 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.