1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)

C170H210F6Ir4N4O9SSi2-4 — CID 160725229

About 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)

1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium) (PubChem CID 160725229) has the molecular formula C170H210F6Ir4N4O9SSi2-4 and a molecular weight of 3424.66 g/mol. Its IUPAC name is 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium).

Molecular Properties

• Compound Name: 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)
• PubChem CID: 160725229
• Molecular Formula: C170H210F6Ir4N4O9SSi2-4
• Molecular Weight: 3424.66 g/mol
• Exact Mass: 3425.38
• IUPAC Name: 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)
• SMILES: CC(C)(C)c1cc(-c2nccc3c2sc2cc(CCC(C(F)(F)F)C(F)(F)F)ccc23)[c-]c2ccccc12.CC(C)Cc1ccc2c(c1)[Si](C)(C)c1c-2ccnc1-c1[c-]c2ccccc2c(C(C)(C)C)c1.CC(C)Cc1ccc2c(c1)oc1c(-c3[c-]c4ccccc4c(C(C)(C)C)c3)nccc12.CC(O)=CC(=O)CC(C)C.CCC(CC)C(=O)C=C(O)C(CC)CC.CCC(CC)C(=O)C=C(O)C(CC)CC.CCC(CC)C(=O)C=C(O)C(CC)CC.CC[Si]1(CC)c2cc(CC(C)C)ccc2-c2ccnc(-c3[c-]c4ccccc4c(C(C)(C)C)c3)c21.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C33H38NSi.C31H34NSi.C30H24F6NS.C29H28NO.3C13H24O2.C8H14O2.4Ir/c1-8-35(9-2)30-19-23(18-22(3)4)14-15-27(30)28-16-17-34-31(32(28)35)25-20-24-12-10-11-13-26(24)29(21-25)33(5,6)7;1-20(2)16-21-12-13-25-26-14-15-32-29(30(26)33(6,7)28(25)17-21)23-18-22-10-8-9-11-24(22)27(19-23)31(3,4)5;1-28(2,3)23-16-19(15-18-6-4-5-7-20(18)23)26-27-22(12-13-37-26)21-10-8-17(14-24(21)38-27)9-11-25(29(31,32)33)30(34,35)36;1-18(2)14-19-10-11-23-24-12-13-30-27(28(24)31-26(23)15-19)21-16-20-8-6-7-9-22(20)25(17-21)29(3,4)5;3*1-5-10(6-2)12(14)9-13(15)11(7-3)8-4;1-6(2)4-8(10)5-7(3)9;;;;/h10-17,19,21-22H,8-9,18H2,1-7H3;8-15,17,19-20H,16H2,1-7H3;4-8,10,12-14,16,25H,9,11H2,1-3H3;6-13,15,17-18H,14H2,1-5H3;3*9-11,14H,5-8H2,1-4H3;5-6,9H,4H2,1-3H3;;;;/q4*-1
• InChIKey: QRRIIVVWBGSHOD-UHFFFAOYSA-N
• XLogP: 46.58
• TPSA: 213.90 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 14
• Rotatable Bonds: 39
• Heavy Atoms: 196
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3424.66
LogP ≤ 5	46.58
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)?

The IUPAC name of 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium) (CID 160725229) is 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium).

What is the SMILES notation for 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)?

The canonical SMILES for 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium) is CC(C)(C)c1cc(-c2nccc3c2sc2cc(CCC(C(F)(F)F)C(F)(F)F)ccc23)[c-]c2ccccc12.CC(C)Cc1ccc2c(c1)[Si](C)(C)c1c-2ccnc1-c1[c-]c2ccccc2c(C(C)(C)C)c1.CC(C)Cc1ccc2c(c1)oc1c(-c3[c-]c4ccccc4c(C(C)(C)C)c3)nccc12.CC(O)=CC(=O)CC(C)C.CCC(CC)C(=O)C=C(O)C(CC)CC.CCC(CC)C(=O)C=C(O)C(CC)CC.CCC(CC)C(=O)C=C(O)C(CC)CC.CC[Si]1(CC)c2cc(CC(C)C)ccc2-c2ccnc(-c3[c-]c4ccccc4c(C(C)(C)C)c3)c21.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)?

The InChIKey is QRRIIVVWBGSHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H38NSi.C31H34NSi.C30H24F6NS.C29H28NO.3C13H24O2.C8H14O2.4Ir/c1-8-35(9-2)30-19-23(18-22(3)4)14-15-27(30)28-16-17-34-31(32(28)35)25-20-24-12-10-11-13-26(24)29(21-25)33(5,6)7;1-20(2)16-21-12-13-25-26-14-15-32-29(30(26)33(6,7)28(25)17-21)23-18-22-10-8-9-11-24(22)27(19-23)31(3,4)5;1-28(2,3)23-16-19(15-18-6-4-5-7-20(18)23)26-27-22(12-13-37-26)21-10-8-17(14-24(21)38-27)9-11-25(29(31,32)33)30(34,35)36;1-18(2)14-19-10-11-23-24-12-13-30-27(28(24)31-26(23)15-19)21-16-20-8-6-7-9-22(20)25(17-21)29(3,4)5;3*1-5-10(6-2)12(14)9-13(15)11(7-3)8-4;1-6(2)4-8(10)5-7(3)9;;;;/h10-17,19,21-22H,8-9,18H2,1-7H3;8-15,17,19-20H,16H2,1-7H3;4-8,10,12-14,16,25H,9,11H2,1-3H3;6-13,15,17-18H,14H2,1-5H3;3*9-11,14H,5-8H2,1-4H3;5-6,9H,4H2,1-3H3;;;;/q4*-1;;;;;;;;.

What are the key properties of 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium)?

1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium) has a molecular weight of 3424.66 g/mol, XLogP of 46.58, 39 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-diethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-9,9-dimethyl-7-(2-methylpropyl)-[1]benzosilolo[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-(2-methylpropyl)-[1]benzofuro[2,3-c]pyridine;1-(4-tert-butyl-1H-naphthalen-1-id-2-yl)-7-[4,4,4-trifluoro-3-(trifluoromethyl)butyl]-[1]benzothiolo[2,3-c]pyridine;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);2-hydroxy-6-methylhept-2-en-4-one;tetrakis(iridium) is sourced from PubChem (CID 160725229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).