4'-(4-Bromophenyl)-2,2':6',2''-terpyridine - CAS 89972-76-9
Catalog: |
BB039712 |
Product Name: |
4'-(4-Bromophenyl)-2,2':6',2''-terpyridine |
CAS: |
89972-76-9 |
Synonyms: |
4-(4-bromophenyl)-2,6-bis(2-pyridinyl)pyridine; 4-(4-bromophenyl)-2,6-dipyridin-2-ylpyridine |
IUPAC Name: | 4-(4-bromophenyl)-2,6-dipyridin-2-ylpyridine |
Description: | 4'-(4-Bromophenyl)-2,2':6',2''-terpyridine (CAS# 89972-76-9) is a useful research chemical. |
Molecular Weight: | 388.26 |
Molecular Formula: | C21H14BrN3 |
Canonical SMILES: | C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C4=CC=C(C=C4)Br |
InChI: | InChI=1S/C21H14BrN3/c22-17-9-7-15(8-10-17)16-13-20(18-5-1-3-11-23-18)25-21(14-16)19-6-2-4-12-24-19/h1-14H |
InChI Key: | BOPPHKMZOYPASP-UHFFFAOYSA-N |
Boiling Point: | 512.671 °C at 760 mmHg |
Density: | 1.381 g/cm3 |
MDL: | MFCD06796984 |
LogP: | 5.63510 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021066397-A1 | Heterocyclic compound and organic light-emitting device comprising same | 20191002 |
KR-102219562-B1 | Heterocyclic compound and organic light emitting device using the same | 20190823 |
WO-2021040310-A1 | Heterocyclic compound, and organic light-emitting element using same | 20190823 |
WO-2021034118-A1 | Heterocyclic compound and organic light-emitting device comprising same | 20190821 |
WO-2021034039-A1 | Heterocyclic compound and organic light-emitting device comprising same | 20190816 |
PMID | Publication Date | Title | Journal |
21467613 | 20110401 | Supramolecular interactions in a copper(II) 4'-(4-bromophenyl)-2,2':6',2''-terpyridine complex | Acta crystallographica. Section C, Crystal structure communications |
19440595 | 20090528 | Photoinduced energy transfer in a rod-like dinuclear Ru(ii) complex containing bis-pyridyl-1,3,5-triazine ligands | Dalton transactions (Cambridge, England : 2003) |
15252526 | 20040221 | Cross-couplings in the elaboration of luminescent bis-terpyridyl iridium complexes: the effect of extended or inhibited conjugation on emission | Dalton transactions (Cambridge, England : 2003) |
Complexity: | 384 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 387.03711 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 387.03711 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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