1,3-Bis(N-carbazolyl)benzene
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Grundinformationen
- CAS
550378-78-4- Standard-SMILES
c1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1- InChIKey
MZYDBGLUVPLRKR-UHFFFAOYSA-N- Summenformel
- C30H20N2
- Durchschnittliche Molmasse
- 408,5 g/mol
- Monoisotopische Masse
- 408,16264865
Namen und Bezeichner
- Bevorzugter Name
- 1,3-Bis(N-carbazolyl)benzene
- IUPAC
- 9-(3-carbazol-9-ylphenyl)carbazole
- Englischer Name
- 1,3-Bis(N-carbazolyl)benzene
- Summenformel
- C30H20N2
- Molmasse
- 408.49
Namen und Synonyme
1,3-Bis(N-carbazolyl)benzeneRefChem:414039625-885-6550378-78-41,3-Di(9H-carbazol-9-yl)benzene1,3-Bis(carbazol-9-yl)benzene9-(3-carbazol-9-ylphenyl)carbazole9,9'-(1,3-PHENYLENE)BIS-9H-CARBAZOLEMFCD098368361,3-bis(9-carbazolyl)benzene1,3-Di-9-carbazolylbenzene1,3-Di-9-carbazolylbenzene (purified by sublimation)
Weitere Namen anzeigen
9,9'9,9´9,9'-(1,3-Phenylene)1,3-Di(9H-carbazol-9-yl)1,3-Bi(carbazol-9-yl)benzeneN,N'-Dicarbazolyl-3,5-benzene
1,3-Bis(carbazol-9-yl)benzene;1,3-Di(9H-carbazol-9-yl)benzene9H-Carbazole, 9,9'-(1,3-phenylene)bis-SCHEMBL573911,3-Di(9-carbazolyl)benzeneSCHEMBL29612161,3-di(carbazol-9-yl)benzeneSCHEMBL18662882SCHEMBL28334939
Datenbank-Bezeichner
- CAS
550378-78-4- PubChem CID
- 22020377
- DTXSID
DTXSID90621607
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 8,1
- Polarare Oberfläche (TPSA)
- 9,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 32
- Formalladung
- 0
- Komplexität
- 563
Physikochemische Eigenschaften
- Schmelzpunkt
- 176 · 176-178°C
- Siedepunkt
- 644.2 · 644.2±51.0 °C(Predicted)
- Dichte
- 1.21 · 1.21
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder to crystal
- Farbe
- White to Almost white
- InChI
- InChI=1S/C30H20N2/c1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-20H
- InChIKey
- MZYDBGLUVPLRKR-UHFFFAOYSA-N
- SMILES
- C1(N2C3=C(C=CC=C3)C3=C2C=CC=C3)=CC=CC(N2C3=C(C=CC=C3)C3=C2C=CC=C3)=C1
- Absorption
- 292 · λmax 292, 338 nm (in THF)
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (97.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (97.6%): 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 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 Dam. 1 (97.6%)；STOT SE 3 (97.6%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29339900
- risk_code
- 37/38-41
- hazard_code
- Xi
- safety_code
- 26-36/37/39-41-37/38
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Beschreibung1,3-Bis(N-carbazolyl)benzene, known as mCP, with a high triplet energy (ET = 2.91 eV) and a very deep highest occupiedmolecular orbital (HOMO) level, is often used as host materials for efficient blue phosphorescent light-emitting diodes. Kawamura et al. demonstrated that the photoluminescence internal quantum yield of the blue emitter of FIrpic could approach nearly 100% when doped into the wide energy gap host of mCP .
Verwenden9,9'-(1,3-Phenylene)bis-9H-carbazole uses as a phosphorescent host material
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Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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