Oxo[29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]vanadium
Vanadium(IV) oxide phthalocyanine
Grundinformationen
- CAS
13930-88-6- Standard-SMILES
[O]=[V+2].c1ccc2c(c1)-c1nc-2nc2[n-]c(nc3nc(nc4[n-]c(n1)c1ccccc41)-c1ccccc1-3)c1ccccc21- InChIKey
YRZZLAGRKZIJJI-UHFFFAOYSA-N- Summenformel
- C32H16N8OV
- Durchschnittliche Molmasse
- 579,5 g/mol
- Monoisotopische Masse
- 579,088665
Namen und Bezeichner
- Bevorzugter Name
- Vanadium(IV) oxide phthalocyanine
- IUPAC
- 2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;oxovanadium(2+)
- Lokaler Name
- Oxo[29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]vanadium
- Englischer Name
- Oxyvanadium phthalocyanine
- Summenformel
- C32H16N8OV
- Molmasse
- 579.48
Namen und Synonyme
13930-88-6Vanadyl phthalocyanineVanadium(IV) oxide phthalocyanineVanadium(IV)phthalocyanine oxideVOPcMFCD00041966AKOS002375039Vanadyl phthalocyanine, dye content >90 %H36266Oxo[29H,31H-phthalocyaninato(2-)- degrees UN29, degrees UN30, degrees UN31, degrees UN32]vanadium,Vanadium(IV)phthalocyanine oxide,Xerox xpp-VOPcXerox xpp-VOPcPHTHALOCYANINE, VANADYL
Weitere Namen anzeigen
Oxyvadium phthalocyanineVANADYL(IV)-PHTHALOCYANINEOxyvanadium phthalocyanineVOPC, OxyvanadiuM PhthalocyanineOxo(phthalocyaninato)vanadium(Ⅳ)
Datenbank-Bezeichner
- CAS
13930-88-6- PubChem CID
- 2735160
- EC Number
- 237-700-2
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 93,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 42
- Formalladung
- 0
- Komplexität
- 1.100
Experimentelle und physikochemische Eigenschaften
Chemical ClassesDyes -> Phthalocyanine Dyes
Physical DescriptionDark blue crystalline powder; [Alfa Aesar MSDS]
Physikochemische Eigenschaften
- Aggregatzustand
- Crystalline Powder or Crystals and Chunks
- Farbe
- White
- Wasserlöslichkeit
- Insoluble in water.
- InChIKey
- YRZZLAGRKZIJJI-UHFFFAOYSA-N
- SMILES
- O=[V]1N(/C(C2=C/3C=CC=C2)=N\C4=N/C(C5=C4C=CC=C5)=N\6)C3=N/C(C7=C/8C=CC=C7)=NC8=N/C9=C%10C(C=CC=C%10)=C6N91
- EPA chemische Informationen
- 29 H,31H-phthalocyaninato · Vanadium, oxo[29H,31H-phthalocyaninato(2-)-.kappa.N29,.kappa.N30,.kappa.N31,.kappa.N32]-, (SP-5-12)- (13930-88-6)
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
This chemical does not meet GHS hazard criteria for 2.2% (1 of 46) of reports.
Warning
H315 (87%): Causes skin irritation [Warning Skin corrosion/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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazards SummaryAn irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (87%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN3285
- hs_code
- 29310099
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn,Xi
- safety_code
- 36/37-26
- hazard_class
- 6.1
- packing_group
- III
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing InformationVanadium, oxo[29H,31H-phthalocyaninato(2-)-.kappa.N29,.kappa.N30,.kappa.N31,.kappa.N32]-, (SP-5-12)-: ACTIVE
Anwendungen
VerwendenIt is used as an organic light-emitting diode intermediate.
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