Grundinformationen
- CAS
905-62-4- Standard-SMILES
c1ccc2c(-c3nnc(-c4cccc5ccccc45)o3)cccc2c1- InChIKey
MUNFOTHAFHGRIM-UHFFFAOYSA-N- Summenformel
- C22H14N2O
- Durchschnittliche Molmasse
- 322,4 g/mol
- Monoisotopische Masse
- 322,11061307
Namen und Bezeichner
- Bevorzugter Name
- 2,5-Di(1-naphthyl)-1,3,4-oxadiazole
- IUPAC
- 2,5-dinaphthalen-1-yl-1,3,4-oxadiazole
- Lokaler Name
- 2,5-Di(1-naphthyl)-1,3,4-oxadiazol
- Englischer Name
- 2,5-Bis(1-naphthyl)-1,3,4-oxadiazole
- Summenformel
- C22H14N2O
- Molmasse
- 322.36
Namen und Synonyme
905-62-42,5-Di(1-naphthyl)-1,3,4-oxadiazole2,5-Bis(1-naphthyl)-1,3,4-oxadiazole6EKF6CL2VJEINECS 212-995-0NSC-90480DTXSID80238182NSC 904802,5-BIS(.ALPHA.-NAPHTHYL)OXADIAZOLE1,3,4-Oxadiazole, 2,5-di-1-naphthalenyl-2,5-DI-1-NAPHTHALENYL-1,3,4-OXADIAZOLERefChem:82739
Weitere Namen anzeigen
2,5-Di(1-naphtyl)-1,3,4-oxadiazole2,5-Bis(1-naphtyl)-1,3,4-oxadiazole2,5-Di(1-naphthyl)-1,3,4-oxadiazole>1,3,4-Oxadiazole, 2,5-di-1-naphthalenyl-
DTXCID001606732,5-BIS(ALPHA-NAPHTHYL)OXADIAZOLE212-995-02,5-Di(naphthalen-1-yl)-1,3,4-oxadiazole2,5-dinaphthalen-1-yl-1,3,4-oxadiazoleMFCD00045582bis(naphthalen-1-yl)-1,3,4-oxadiazoleNSC90480
Datenbank-Bezeichner
- CAS
905-62-4- PubChem CID
- 70182
- DTXSID
DTXSID80238182- UNII
- 6EKF6CL2VJ
- EC Number
- 212-995-0
- Nikkaji
- J195.201C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,6
- Polarare Oberfläche (TPSA)
- 38,9 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 415
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesAngular frequency
Physikochemische Eigenschaften
- Schmelzpunkt
- 175 · 175-178°C
- Siedepunkt
- 556.4 · 556.4±33.0 °C(Predicted)
- Dichte
- 1.251 · 1.251±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder to crystal
- pka
- -5.16 · -5.16±0.50(Predicted)
- Farbe
- Light yellow to Brown
- BRN
- 285250 · 285250
- InChI
- 1S/C22H14N2O/c1-3-11-17-15(7-1)9-5-13-19(17)21-23-24-22(25-21)20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
- InChIKey
- MUNFOTHAFHGRIM-UHFFFAOYSA-N
- SMILES
- c1ccc2c(cccc2c1)-c3nnc(o3)-c4cccc5ccccc45
- CAS Datenbank
- 905 · 905-62-4(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2934.99.4400
- risk_code
- 22
- hazard_code
- Xn
- safety_code
- 22-24/25
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 OralAquatic Chronic 4
Chemie und Industrie
Anwendungen
VerwendenOrganic electronic material useful as an electron transporter in organic light emitting diodes (OLEDs).
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