3-(Biphenyl-4-yl)-5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazole - CAS 150405-69-9
Catalog: |
BB010533 |
Product Name: |
3-(Biphenyl-4-yl)-5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazole |
CAS: |
150405-69-9 |
Synonyms: |
3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole |
Application: |
OLED and QD-LED electron transporter and hole blocker material. |
IUPAC Name: | 3-(4-tert-butylphenyl)-4-phenyl-5-(4-phenylphenyl)-1,2,4-triazole |
Description: | OLED and QD-LED electron transporter and hole blocker material. |
Molecular Weight: | 429.56 |
Molecular Formula: | C30H27N3 |
Canonical SMILES: | CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=CC=C5 |
InChI: | InChI=1S/C30H27N3/c1-30(2,3)26-20-18-25(19-21-26)29-32-31-28(33(29)27-12-8-5-9-13-27)24-16-14-23(15-17-24)22-10-6-4-7-11-22/h4-21H,1-3H3 |
InChI Key: | ZVFQEOPUXVPSLB-UHFFFAOYSA-N |
Purity: | 97 % |
Appearance: | Solid |
MDL: | MFCD00799419 |
LogP: | 7.56580 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113461676-A | Heterocyclic compound and organic electroluminescent device thereof | 20210706 |
CN-113372337-A | Arylamine derivative and organic electroluminescent device thereof | 20210702 |
CN-113321677-A | Thermal activation delayed fluorescent material, organic light-emitting device and display device | 20210630 |
CN-113336771-A | Condensed ring carbazole derivative and organic electroluminescent device thereof | 20210625 |
CN-113336785-A | Aromatic amine compound containing silafluorene and organic electroluminescent device thereof | 20210625 |
PMID | Publication Date | Title | Journal |
20358933 | 20100501 | Electroluminescence property of highly soluble Ir(III) complex utilized by various hole blocking layers in polymer light emitting diodes | Journal of nanoscience and nanotechnology |
Complexity: | 584 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 429.220497874 |
Formal Charge: | 0 |
Heavy Atom Count: | 33 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 429.220497874 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 30.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.7 |
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