9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane

C190H203N5 — CID 159595531

About 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane

9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane (PubChem CID 159595531) has the molecular formula C190H203N5 and a molecular weight of 2570.83 g/mol. Its IUPAC name is 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane.

Molecular Properties

• Compound Name: 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane
• PubChem CID: 159595531
• Molecular Formula: C190H203N5
• Molecular Weight: 2570.83 g/mol
• Exact Mass: 2568.69
• IUPAC Name: 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane
• SMILES: C.C.C.C.C.CC(C)(C)c1c(-c2ccccc2)cccc1-n1c2ccccc2c2cccc(-c3ccccc3)c21.CC(C)(C)c1cc(-c2cccc(-n3c4ccccc4c4cccc(-c5ccccc5)c43)c2C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cccc(-n2c3ccccc3c3cccc(-c4ccccc4)c32)c1C(C)(C)C.[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(-c5c([2H])c([2H])c(C)c([2H])c5[2H])c4C(C)(C)C)c23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c4C(C)(C)C)c23)c([2H])c1[2H]
• InChI: InChI=1S/2C42H45N.C35H31N.C34H29N.C32H33N.5CH4/c2*1-40(2,3)30-25-29(26-31(27-30)41(4,5)6)32-20-16-24-37(38(32)42(7,8)9)43-36-23-14-13-19-34(36)35-22-15-21-33(39(35)43)28-17-11-10-12-18-28;1-24-20-22-26(23-21-24)27-15-11-19-32(33(27)35(2,3)4)36-31-18-9-8-14-29(31)30-17-10-16-28(34(30)36)25-12-6-5-7-13-25;1-34(2,3)32-26(24-14-6-4-7-15-24)19-13-23-31(32)35-30-22-11-10-18-28(30)29-21-12-20-27(33(29)35)25-16-8-5-9-17-25;1-31(2,3)26-19-13-21-28(29(26)32(4,5)6)33-27-20-11-10-16-24(27)25-18-12-17-23(30(25)33)22-14-8-7-9-15-22;;;;;/h2*10-27H,1-9H3;5-23H,1-4H3;4-23H,1-3H3;7-21H,1-6H3;5*1H4/i10D,11D,12D,17D,18D;;5D,6D,7D,12D,13D,20D,21D,22D,23D
• InChIKey: MKUFDEJXSAVAES-YUPYSPECSA-N
• XLogP: 55.39
• TPSA: 24.65 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 14
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2570.83
LogP ≤ 5	55.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane?

The IUPAC name of 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane (CID 159595531) is 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane.

What is the SMILES notation for 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane?

The canonical SMILES for 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane is C.C.C.C.C.CC(C)(C)c1c(-c2ccccc2)cccc1-n1c2ccccc2c2cccc(-c3ccccc3)c21.CC(C)(C)c1cc(-c2cccc(-n3c4ccccc4c4cccc(-c5ccccc5)c43)c2C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cccc(-n2c3ccccc3c3cccc(-c4ccccc4)c32)c1C(C)(C)C.[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(-c5c([2H])c([2H])c(C)c([2H])c5[2H])c4C(C)(C)C)c23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c4C(C)(C)C)c23)c([2H])c1[2H].

What is the InChIKey of 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane?

The InChIKey is MKUFDEJXSAVAES-YUPYSPECSA-N. The full InChI is InChI=1S/2C42H45N.C35H31N.C34H29N.C32H33N.5CH4/c2*1-40(2,3)30-25-29(26-31(27-30)41(4,5)6)32-20-16-24-37(38(32)42(7,8)9)43-36-23-14-13-19-34(36)35-22-15-21-33(39(35)43)28-17-11-10-12-18-28;1-24-20-22-26(23-21-24)27-15-11-19-32(33(27)35(2,3)4)36-31-18-9-8-14-29(31)30-17-10-16-28(34(30)36)25-12-6-5-7-13-25;1-34(2,3)32-26(24-14-6-4-7-15-24)19-13-23-31(32)35-30-22-11-10-18-28(30)29-21-12-20-27(33(29)35)25-16-8-5-9-17-25;1-31(2,3)26-19-13-21-28(29(26)32(4,5)6)33-27-20-11-10-16-24(27)25-18-12-17-23(30(25)33)22-14-8-7-9-15-22;;;;;/h2*10-27H,1-9H3;5-23H,1-4H3;4-23H,1-3H3;7-21H,1-6H3;5*1H4/i10D,11D,12D,17D,18D;;5D,6D,7D,12D,13D,20D,21D,22D,23D;;;;;;;.

What are the key properties of 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane?

9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane has a molecular weight of 2570.83 g/mol, XLogP of 55.39, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-[2-tert-butyl-3-(3,5-ditert-butylphenyl)phenyl]-1-phenylcarbazole;9-(2-tert-butyl-3-phenylphenyl)-1-phenylcarbazole;9-[2-tert-butyl-3-(2,3,5,6-tetradeuterio-4-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole;methane is sourced from PubChem (CID 159595531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).