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

C183H187N5 — CID 163689607

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

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole (PubChem CID 163689607) has the molecular formula C183H187N5 and a molecular weight of 2475.66 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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole.

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole
• PubChem CID: 163689607
• Molecular Formula: C183H187N5
• Molecular Weight: 2475.66 g/mol
• Exact Mass: 2473.60
• 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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole
• SMILES: 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([2H])c(C)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].[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(C(C)(C)C)c4C(C)(C)C)c23)c([2H])c1[2H]
• InChI: InChI=1S/2C42H45N.C35H31N.2C32H33N/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;1-24-13-10-16-26(23-24)27-18-12-22-32(33(27)35(2,3)4)36-31-21-9-8-17-29(31)30-20-11-19-28(34(30)36)25-14-6-5-7-15-25;2*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;2*7-21H,1-6H3/i10D,11D,12D,17D,18D;;5D,6D,7D,10D,13D,14D,15D,16D,23D;7D,8D,9D,14D,15D
• InChIKey: JRVIQGYLYIOUJQ-QUZRNHLHSA-N
• XLogP: 51.84
• TPSA: 24.65 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 13
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2475.66
LogP ≤ 5	51.84
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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole?

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole (CID 163689607) 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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole.

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole?

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole is 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([2H])c(C)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].[2H]c1c([2H])c([2H])c(-c2cccc3c4ccccc4n(-c4cccc(C(C)(C)C)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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole?

The InChIKey is JRVIQGYLYIOUJQ-QUZRNHLHSA-N. The full InChI is InChI=1S/2C42H45N.C35H31N.2C32H33N/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;1-24-13-10-16-26(23-24)27-18-12-22-32(33(27)35(2,3)4)36-31-21-9-8-17-29(31)30-20-11-19-28(34(30)36)25-14-6-5-7-15-25;2*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;2*7-21H,1-6H3/i10D,11D,12D,17D,18D;;5D,6D,7D,10D,13D,14D,15D,16D,23D;7D,8D,9D,14D,15D;.

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole?

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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole has a molecular weight of 2475.66 g/mol, XLogP of 51.84, 13 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-(2,3,4,6-tetradeuterio-5-methylphenyl)phenyl]-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-(2,3,4,5,6-pentadeuteriophenyl)carbazole;9-(2,3-ditert-butylphenyl)-1-phenylcarbazole is sourced from PubChem (CID 163689607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).