5,10,15,20-Tetra(4-pyridyl)porphyrin
Grundinformationen
- CAS
16834-13-2- Standard-SMILES
C1=Cc2nc1c(-c1ccncc1)c1ccc([nH]1)c(-c1ccncc1)c1nc(c(-c3ccncc3)c3ccc([nH]3)c2-c2ccncc2)C=C1- InChIKey
DNZSHSJERXNJGX-UHFFFAOYSA-N- Summenformel
- C40H26N8
- Durchschnittliche Molmasse
- 618,7 g/mol
- Monoisotopische Masse
- 618,22804283
Überblick
structure in first source
Namen und Bezeichner
- Bevorzugter Name
- 5,10,15,20-Tetra(4-pyridyl)porphyrin
- IUPAC
- 5,10,15,20-tetrapyridin-4-yl-21,23-dihydroporphyrin
- Englischer Name
- 5,10,15,20-Tetra(4-pyridyl)-21H,23H-porphine
- Summenformel
- C40H26N8
- Molmasse
- 618.69
Namen und Synonyme
5,10,15,20-Tetra(4-pyridyl)porphyrinRefChem:483909H(2)TPyP16834-13-25,10,15,20-Tetra(4-pyridyl)-21H,23H-porphinemeso-Tetra(4-pyridyl)porphineMFCD0000962621H,23H-Porphine, 5,10,15,20-tetra-4-pyridinyl-5,10,15,20-tetra(pyridin-4-yl)porphyrinCHEMBL40845302,7,12,17-tetrakis(pyridin-4-yl)-21,22,23,24-tetraazapentacyclo[16.2.1.1^{3,6}.1^{8,11}.1^{13,16}]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene5,10,15,20-(tetra-4-pyridyl)porphyrin
Weitere Namen anzeigen
4-PYPTetra(4-pyridyl)porphyrinmeso-Tetra(4-pyridyl)porphine,97%COTPYPDK7581Einecs 240-858-5RARECHEM AS SA 00282,2'-Dipyrromethane
meso-Tetra-4-pyridylporphineSCHEMBL2459375,10,15,20-Tetra(4-pyridinyl)-21H,23H-porphyrinNV9P84R52Qorb3174296CHEMBL3040240DTXSID4066121SCHEMBL29961137
Datenbank-Bezeichner
- CAS
16834-13-2- PubChem CID
- 135411729
- DTXSID
DTXSID4066121- ChEMBL
CHEMBL3040240、CHEMBL4084530- UNII
- NV9P84R52Q
- EC Number
- 240-858-5
- Nikkaji
- J236.865J
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 6,1
- Polarare Oberfläche (TPSA)
- 109 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 48
- Formalladung
- 0
- Komplexität
- 863
Physikochemische Eigenschaften
- Dichte
- 1.335 · 1.335±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- Aggregatzustand
- Powder
- Farbe
- purple
- BRN
- 635257 · 635257
- InChIKey
- DNZSHSJERXNJGX-XXDGMDECSA-N
- SMILES
- C1(C2C=CN=CC=2)=C2N=C(C(C3C=CN=CC=3)=C3NC(=C(C4C=CN=CC=4)C4=NC(=C(C5C=CN=CC=5)C5NC1=CC=5)C=C4)C=C3)C=C2 |c:18,t:7,21,32|
- EPA chemische Informationen
- 21 H,23H-Porphine, · 21H,23H-Porphine, 5,10,15,20-tetra-4-pyridinyl- (16834-13-2)
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]
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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationHazard Traits - Bioaccumulation; Environmental Persistence
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- F
- 10
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29333990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information21H,23H-Porphine, 5,10,15,20-tetra-4-pyridinyl-: ACTIVE
Anwendungen
Verwenden5,10,15,20-Tetra(4-pyridyl)-21H,23H-porphine is used in the making of coordination catalysts.
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