C258H296Ir10N23O7Si2-11 — CID 159398161
6-(2-ethylhexoxy)-2-methyl-3-[4-(2-phenylimidazol-1-yl)phenyl]pyridine;1-[4-(2-ethylhexyl)phenyl]-2-phenylimidazole;1-(2-ethyl-4-octoxyphenyl)-2-phenylimidazole;1-[4-(2-ethylpentoxy)-3-methylphenyl]-2-phenylimidazole;1-(4-hexoxyphenyl)-2-phenylimidazole;1-(4-hexylphenyl)-2-phenylimidazole;1-[4-(4-hexylphenyl)phenyl]-2-phenylimidazole;decakis(iridium);1-(2-methyl-4-octylphenyl)-2-phenylimidazole;1-phenyl-2-phenylimidazole;2-phenyl-1-[4-[2-(2-propoxyethoxy)ethoxy]phenyl]imidazole;triethyl-[[4-(2-phenylimidazol-1-yl)phenyl]-triethylsilylmethyl]silane (PubChem CID 159398161) has the molecular formula C258H296Ir10N23O7Si2-11 and a molecular weight of 5809.70 g/mol. Its IUPAC name is 6-(2-ethylhexoxy)-2-methyl-3-[4-(2-phenylimidazol-1-yl)phenyl]pyridine;1-[4-(2-ethylhexyl)phenyl]-2-phenylimidazole;1-(2-ethyl-4-octoxyphenyl)-2-phenylimidazole;1-[4-(2-ethylpentoxy)-3-methylphenyl]-2-phenylimidazole;1-(4-hexoxyphenyl)-2-phenylimidazole;1-(4-hexylphenyl)-2-phenylimidazole;1-[4-(4-hexylphenyl)phenyl]-2-phenylimidazole;decakis(iridium);1-(2-methyl-4-octylphenyl)-2-phenylimidazole;1-phenyl-2-phenylimidazole;2-phenyl-1-[4-[2-(2-propoxyethoxy)ethoxy]phenyl]imidazole;triethyl-[[4-(2-phenylimidazol-1-yl)phenyl]-triethylsilylmethyl]silane.
| Compound Name | 6-(2-ethylhexoxy)-2-methyl-3-[4-(2-phenylimidazol-1-yl)phenyl]pyridine;1-[4-(2-ethylhexyl)phenyl]-2-phenylimidazole;1-(2-ethyl-4-octoxyphenyl)-2-phenylimidazole;1-[4-(2-ethylpentoxy)-3-methylphenyl]-2-phenylimidazole;1-(4-hexoxyphenyl)-2-phenylimidazole;1-(4-hexylphenyl)-2-phenylimidazole;1-[4-(4-hexylphenyl)phenyl]-2-phenylimidazole;decakis(iridium);1-(2-methyl-4-octylphenyl)-2-phenylimidazole;1-phenyl-2-phenylimidazole;2-phenyl-1-[4-[2-(2-propoxyethoxy)ethoxy]phenyl]imidazole;triethyl-[[4-(2-phenylimidazol-1-yl)phenyl]-triethylsilylmethyl]silane |
|---|---|
| PubChem CID | 159398161 |
| Molecular Formula | C258H296Ir10N23O7Si2-11 |
| Molecular Weight | 5809.70 g/mol |
| Exact Mass | 5813.94 |
| IUPAC Name | 6-(2-ethylhexoxy)-2-methyl-3-[4-(2-phenylimidazol-1-yl)phenyl]pyridine;1-[4-(2-ethylhexyl)phenyl]-2-phenylimidazole;1-(2-ethyl-4-octoxyphenyl)-2-phenylimidazole;1-[4-(2-ethylpentoxy)-3-methylphenyl]-2-phenylimidazole;1-(4-hexoxyphenyl)-2-phenylimidazole;1-(4-hexylphenyl)-2-phenylimidazole;1-[4-(4-hexylphenyl)phenyl]-2-phenylimidazole;decakis(iridium);1-(2-methyl-4-octylphenyl)-2-phenylimidazole;1-phenyl-2-phenylimidazole;2-phenyl-1-[4-[2-(2-propoxyethoxy)ethoxy]phenyl]imidazole;triethyl-[[4-(2-phenylimidazol-1-yl)phenyl]-triethylsilylmethyl]silane |
| SMILES | CCCC(CC)COc1ccc(-n2ccnc2-c2[c-]cccc2)cc1C.CCCCC(CC)COc1ccc(-c2ccc(-n3ccnc3-c3[c-]cccc3)cc2)c(C)n1.CCCCC(CC)Cc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCCCOc1ccc(-n2ccnc2-c2[c-]cccc2)c(CC)c1.CCCCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)c(C)c1.CCCCCCOc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCCCCc1ccc(-c2ccc(-n3ccnc3-c3[c-]cccc3)cc2)cc1.CCCCCCc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CCCOCCOCCOc1ccc(-n2ccnc2-c2[c-]cccc2)cc1.CC[Si](CC)(CC)C(c1ccc(-n2ccnc2-c2[c-]cccc2)cc1)[Si](CC)(CC)CC.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1nccn1-c1ccccc1 |
| InChI | InChI=1S/C29H32N3O.C28H41N2Si2.C27H27N2.C25H31N2O.C24H29N2.C23H27N2O.C23H27N2.C22H25N2O3.C21H23N2O.C21H23N2.C15H11N2.10Ir/c1-4-6-10-23(5-2)21-33-28-18-17-27(22(3)31-28)24-13-15-26(16-14-24)32-20-19-30-29(32)25-11-8-7-9-12-25;1-7-31(8-2,9-3)28(32(10-4,11-5)12-6)25-18-20-26(21-19-25)30-23-22-29-27(30)24-16-14-13-15-17-24;1-2-3-4-6-9-22-12-14-23(15-13-22)24-16-18-26(19-17-24)29-21-20-28-27(29)25-10-7-5-8-11-25;1-3-5-6-7-8-12-19-28-23-15-16-24(21(4-2)20-23)27-18-17-26-25(27)22-13-10-9-11-14-22;1-3-4-5-6-7-9-12-21-15-16-23(20(2)19-21)26-18-17-25-24(26)22-13-10-8-11-14-22;1-4-9-19(5-2)17-26-22-13-12-21(16-18(22)3)25-15-14-24-23(25)20-10-7-6-8-11-20;1-3-5-9-19(4-2)18-20-12-14-22(15-13-20)25-17-16-24-23(25)21-10-7-6-8-11-21;1-2-14-25-15-16-26-17-18-27-21-10-8-20(9-11-21)24-13-12-23-22(24)19-6-4-3-5-7-19;1-2-3-4-8-17-24-20-13-11-19(12-14-20)23-16-15-22-21(23)18-9-6-5-7-10-18;1-2-3-4-6-9-18-12-14-20(15-13-18)23-17-16-22-21(23)19-10-7-5-8-11-19;1-3-7-13(8-4-1)15-16-11-12-17(15)14-9-5-2-6-10-14;;;;;;;;;;/h7-9,11,13-20,23H,4-6,10,21H2,1-3H3;13-16,18-23,28H,7-12H2,1-6H3;5,7-8,10,12-21H,2-4,6,9H2,1H3;9-11,13,15-18,20H,3-8,12,19H2,1-2H3;8,10-11,13,15-19H,3-7,9,12H2,1-2H3;6-8,10,12-16,19H,4-5,9,17H2,1-3H3;6-8,10,12-17,19H,3-5,9,18H2,1-2H3;3-6,8-13H,2,14-18H2,1H3;5-7,9,11-16H,2-4,8,17H2,1H3;5,7-8,10,12-17H,2-4,6,9H2,1H3;1-7,9-12H;;;;;;;;;;/q11*-1;;;;;;;;;; |
| InChIKey | UTEMEBKGOJARNR-UHFFFAOYSA-N |
| XLogP | 66.33 |
| TPSA | 273.52 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 93 |
| Heavy Atoms | 300 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5809.70 |
| LogP ≤ 5 | 66.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 30 |