1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole

C85H53F9Ir5N9-5 — CID 160519364

About 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole

1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole (PubChem CID 160519364) has the molecular formula C85H53F9Ir5N9-5 and a molecular weight of 2332.49 g/mol. Its IUPAC name is 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole.

Molecular Properties

• Compound Name: 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole
• PubChem CID: 160519364
• Molecular Formula: C85H53F9Ir5N9-5
• Molecular Weight: 2332.49 g/mol
• Exact Mass: 2335.25
• IUPAC Name: 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole
• SMILES: CC1(c2ccccc2)C(c2[c-]cc3ccccc3c2)=Nc2ccccc21.FC(F)(F)c1ccc(-n2nc(-c3[c-]ccc(C(F)(F)F)c3)c3ccccc32)cc1.Fc1c[c-]c(-n2ncc3ccccc32)cc1.Fc1cc[c-]c(-n2ncc3cc(F)ccc32)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-n1ncc2ccccc21
• InChI: InChI=1S/C25H18N.C21H11F6N2.C13H7F2N2.C13H8FN2.C13H9N2.5Ir/c1-25(21-11-3-2-4-12-21)22-13-7-8-14-23(22)26-24(25)20-16-15-18-9-5-6-10-19(18)17-20;22-20(23,24)14-8-10-16(11-9-14)29-18-7-2-1-6-17(18)19(28-29)13-4-3-5-15(12-13)21(25,26)27;14-10-2-1-3-12(7-10)17-13-5-4-11(15)6-9(13)8-16-17;14-11-5-7-12(8-6-11)16-13-4-2-1-3-10(13)9-15-16;1-2-7-12(8-3-1)15-13-9-5-4-6-11(13)10-14-15;;;;;/h2-15,17H,1H3;1-3,5-12H;1-2,4-8H;1-7,9H;1-7,9-10H;;;;;/q5*-1
• InChIKey: WFGDTLIHFZULAS-UHFFFAOYSA-N
• XLogP: 21.49
• TPSA: 83.64 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 7
• Heavy Atoms: 108
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2332.49
LogP ≤ 5	21.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole?

The IUPAC name of 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole (CID 160519364) is 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole.

What is the SMILES notation for 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole?

The canonical SMILES for 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole is CC1(c2ccccc2)C(c2[c-]cc3ccccc3c2)=Nc2ccccc21.FC(F)(F)c1ccc(-n2nc(-c3[c-]ccc(C(F)(F)F)c3)c3ccccc32)cc1.Fc1c[c-]c(-n2ncc3ccccc32)cc1.Fc1cc[c-]c(-n2ncc3cc(F)ccc32)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-n1ncc2ccccc21.

What is the InChIKey of 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole?

The InChIKey is WFGDTLIHFZULAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N.C21H11F6N2.C13H7F2N2.C13H8FN2.C13H9N2.5Ir/c1-25(21-11-3-2-4-12-21)22-13-7-8-14-23(22)26-24(25)20-16-15-18-9-5-6-10-19(18)17-20;22-20(23,24)14-8-10-16(11-9-14)29-18-7-2-1-6-17(18)19(28-29)13-4-3-5-15(12-13)21(25,26)27;14-10-2-1-3-12(7-10)17-13-5-4-11(15)6-9(13)8-16-17;14-11-5-7-12(8-6-11)16-13-4-2-1-3-10(13)9-15-16;1-2-7-12(8-3-1)15-13-9-5-4-6-11(13)10-14-15;;;;;/h2-15,17H,1H3;1-3,5-12H;1-2,4-8H;1-7,9H;1-7,9-10H;;;;;/q5*-1;;;;;.

What are the key properties of 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole?

1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole has a molecular weight of 2332.49 g/mol, XLogP of 21.49, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-fluorobenzene-6-id-1-yl)indazole;5-fluoro-1-(3-fluorobenzene-6-id-1-yl)indazole;pentakis(iridium);3-methyl-2-(3H-naphthalen-3-id-2-yl)-3-phenylindole;1-phenylindazole;3-[3-(trifluoromethyl)benzene-6-id-1-yl]-1-[4-(trifluoromethyl)phenyl]indazole is sourced from PubChem (CID 160519364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).