3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)

C276H248Ir4N24O-8 — CID 162099528

About 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)

3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide) (PubChem CID 162099528) has the molecular formula C276H248Ir4N24O-8 and a molecular weight of 4686.05 g/mol. Its IUPAC name is 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide).

Molecular Properties

• Compound Name: 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)
• PubChem CID: 162099528
• Molecular Formula: C276H248Ir4N24O-8
• Molecular Weight: 4686.05 g/mol
• Exact Mass: 4685.87
• IUPAC Name: 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)
• SMILES: CCCC(CC)CCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2C)c(C)c1.CCCC(CC)OCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.CCCCC(CC)Cc1cccc(-c2ccc(-n3ccnc3-c3[c-]cc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c1.CCCCCCCCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2C)c(C)c1.[Ir].[Ir].[Ir].[Ir].[c-]1cc2c(cc1-c1nccn1-c1ccc(-c3ccccc3)cc1)c1ccccc1n2-c1ccccc1
• InChI: InChI=1S/C41H38N3.C38H40N3.C37H38N3.C36H36N3O.C33H22N3.C31H26N3.2C30H24N3.4Ir/c1-3-5-12-30(4-2)27-31-13-11-14-33(28-31)32-19-22-35(23-20-32)43-26-25-42-41(43)34-21-24-40-38(29-34)37-17-9-10-18-39(37)44(40)36-15-7-6-8-16-36;1-6-12-29(7-2)17-18-30-23-27(4)37(28(5)24-30)40-22-21-39-38(40)31-19-20-36-33(25-31)32-14-9-11-16-35(32)41(36)34-15-10-8-13-26(34)3;1-4-5-6-7-8-10-15-29-24-27(2)36(28(3)25-29)39-23-22-38-37(39)30-20-21-35-33(26-30)32-18-13-14-19-34(32)40(35)31-16-11-9-12-17-31;1-5-12-30(6-2)40-24-27-21-25(3)35(26(4)22-27)38-20-19-37-36(38)28-17-18-34-32(23-28)31-15-10-11-16-33(31)39(34)29-13-8-7-9-14-29;1-3-9-24(10-4-1)25-15-18-27(19-16-25)35-22-21-34-33(35)26-17-20-32-30(23-26)29-13-7-8-14-31(29)36(32)28-11-5-2-6-12-28;1-20-17-22(3)30(23(4)18-20)33-16-15-32-31(33)24-13-14-29-26(19-24)25-10-6-8-12-28(25)34(29)27-11-7-5-9-21(27)2;2*1-20-17-21(2)29(22(3)18-20)32-16-15-31-30(32)23-13-14-28-26(19-23)25-11-7-8-12-27(25)33(28)24-9-5-4-6-10-24;;;;/h6-11,13-20,22-26,28-30H,3-5,12,27H2,1-2H3;8-11,13-16,20-25,29H,6-7,12,17-18H2,1-5H3;9,11-14,16-19,21-26H,4-8,10,15H2,1-3H3;7-11,13-16,18-23,30H,5-6,12,24H2,1-4H3;1-16,18-23H;5-12,14-19H,1-4H3;2*4-12,14-19H,1-3H3;;;;/q8*-1
• InChIKey: PZUSVDSIPUBFMP-UHFFFAOYSA-N
• XLogP: 70.58
• TPSA: 191.23 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 51
• Heavy Atoms: 305
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4686.05
LogP ≤ 5	70.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)?

The IUPAC name of 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide) (CID 162099528) is 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide).

What is the SMILES notation for 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)?

The canonical SMILES for 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide) is CCCC(CC)CCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2C)c(C)c1.CCCC(CC)OCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.CCCCC(CC)Cc1cccc(-c2ccc(-n3ccnc3-c3[c-]cc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c1.CCCCCCCCc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2)c(C)c1.Cc1cc(C)c(-n2ccnc2-c2[c-]cc3c(c2)c2ccccc2n3-c2ccccc2C)c(C)c1.[Ir].[Ir].[Ir].[Ir].[c-]1cc2c(cc1-c1nccn1-c1ccc(-c3ccccc3)cc1)c1ccccc1n2-c1ccccc1.

What is the InChIKey of 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)?

The InChIKey is PZUSVDSIPUBFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H38N3.C38H40N3.C37H38N3.C36H36N3O.C33H22N3.C31H26N3.2C30H24N3.4Ir/c1-3-5-12-30(4-2)27-31-13-11-14-33(28-31)32-19-22-35(23-20-32)43-26-25-42-41(43)34-21-24-40-38(29-34)37-17-9-10-18-39(37)44(40)36-15-7-6-8-16-36;1-6-12-29(7-2)17-18-30-23-27(4)37(28(5)24-30)40-22-21-39-38(40)31-19-20-36-33(25-31)32-14-9-11-16-35(32)41(36)34-15-10-8-13-26(34)3;1-4-5-6-7-8-10-15-29-24-27(2)36(28(3)25-29)39-23-22-38-37(39)30-20-21-35-33(26-30)32-18-13-14-19-34(32)40(35)31-16-11-9-12-17-31;1-5-12-30(6-2)40-24-27-21-25(3)35(26(4)22-27)38-20-19-37-36(38)28-17-18-34-32(23-28)31-15-10-11-16-33(31)39(34)29-13-8-7-9-14-29;1-3-9-24(10-4-1)25-15-18-27(19-16-25)35-22-21-34-33(35)26-17-20-32-30(23-26)29-13-7-8-14-31(29)36(32)28-11-5-2-6-12-28;1-20-17-22(3)30(23(4)18-20)33-16-15-32-31(33)24-13-14-29-26(19-24)25-10-6-8-12-28(25)34(29)27-11-7-5-9-21(27)2;2*1-20-17-21(2)29(22(3)18-20)32-16-15-31-30(32)23-13-14-28-26(19-23)25-11-7-8-12-27(25)33(28)24-9-5-4-6-10-24;;;;/h6-11,13-20,22-26,28-30H,3-5,12,27H2,1-2H3;8-11,13-16,20-25,29H,6-7,12,17-18H2,1-5H3;9,11-14,16-19,21-26H,4-8,10,15H2,1-3H3;7-11,13-16,18-23,30H,5-6,12,24H2,1-4H3;1-16,18-23H;5-12,14-19H,1-4H3;2*4-12,14-19H,1-3H3;;;;/q8*-1;;;;.

What are the key properties of 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide)?

3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide) has a molecular weight of 4686.05 g/mol, XLogP of 70.58, 51 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[1-(2,6-dimethyl-4-octylphenyl)imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(3-ethylhexyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-(2-methylphenyl)-2H-carbazol-2-ide;3-[1-[4-[3-(2-ethylhexyl)phenyl]phenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;3-[1-[4-(hexan-3-yloxymethyl)-2,6-dimethylphenyl]imidazol-2-yl]-9-phenyl-2H-carbazol-2-ide;tetrakis(iridium);9-(2-methylphenyl)-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;9-phenyl-3-[1-(4-phenylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;bis(9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide) is sourced from PubChem (CID 162099528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).