9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran

C142H87NO3 — CID 167602660

About 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran

9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran (PubChem CID 167602660) has the molecular formula C142H87NO3 and a molecular weight of 1884.44 g/mol. Its IUPAC name is 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran.

Molecular Properties

• Compound Name: 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran
• PubChem CID: 167602660
• Molecular Formula: C142H87NO3
• Molecular Weight: 1884.44 g/mol
• Exact Mass: 1882.85
• IUPAC Name: 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran
• SMILES: [2H]c1c([2H])c([2H])c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4cccc5c4oc4cc6ccccc6cc45)cc3)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4cccc5c4oc4c6ccccc6ccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3cc(-c4cccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c45)c4ccccc4c3)c2c1[2H]
• InChI: InChI=1S/C58H35NO.2C42H26O/c1-3-18-40-36(15-1)17-13-26-44(40)57-47-24-7-5-22-45(47)56(46-23-6-8-25-48(46)57)38-33-37-16-2-4-19-41(37)50(34-38)49-27-14-30-55-58(49)51-35-39(31-32-54(51)60-55)59-52-28-11-9-20-42(52)43-21-10-12-29-53(43)59;1-2-13-28(14-3-1)39-33-18-6-8-20-35(33)40(36-21-9-7-19-34(36)39)30-16-10-15-29(26-30)32-22-11-23-37-38-25-24-27-12-4-5-17-31(27)41(38)43-42(32)37;1-2-11-28(12-3-1)40-33-15-6-8-17-35(33)41(36-18-9-7-16-34(36)40)29-23-21-27(22-24-29)32-19-10-20-37-38-25-30-13-4-5-14-31(30)26-39(38)43-42(32)37/h1-35H;2*1-26H/i5D,6D,7D,8D,22D,23D,24D,25D;6D,7D,8D,9D,18D,19D,20D,21D;1D,2D,3D,6D,7D,8D,9D,11D,12D,15D,16D,17D,18D
• InChIKey: JYKFNGZZTLDLBA-JXPOAEQUSA-N
• XLogP: 40.39
• TPSA: 44.35 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1884.44
LogP ≤ 5	40.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran?

The IUPAC name of 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran (CID 167602660) is 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran.

What is the SMILES notation for 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran?

The canonical SMILES for 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran is [2H]c1c([2H])c([2H])c(-c2c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccc(-c4cccc5c4oc4cc6ccccc6cc45)cc3)c3c([2H])c([2H])c([2H])c([2H])c23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc(-c4cccc5c4oc4c6ccccc6ccc54)c3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3cccc4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3cc(-c4cccc5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c45)c4ccccc4c3)c2c1[2H].

What is the InChIKey of 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran?

The InChIKey is JYKFNGZZTLDLBA-JXPOAEQUSA-N. The full InChI is InChI=1S/C58H35NO.2C42H26O/c1-3-18-40-36(15-1)17-13-26-44(40)57-47-24-7-5-22-45(47)56(46-23-6-8-25-48(46)57)38-33-37-16-2-4-19-41(37)50(34-38)49-27-14-30-55-58(49)51-35-39(31-32-54(51)60-55)59-52-28-11-9-20-42(52)43-21-10-12-29-53(43)59;1-2-13-28(14-3-1)39-33-18-6-8-20-35(33)40(36-21-9-7-19-34(36)39)30-16-10-15-29(26-30)32-22-11-23-37-38-25-24-27-12-4-5-17-31(27)41(38)43-42(32)37;1-2-11-28(12-3-1)40-33-15-6-8-17-35(33)41(36-18-9-7-16-34(36)40)29-23-21-27(22-24-29)32-19-10-20-37-38-25-30-13-4-5-14-31(30)26-39(38)43-42(32)37/h1-35H;2*1-26H/i5D,6D,7D,8D,22D,23D,24D,25D;6D,7D,8D,9D,18D,19D,20D,21D;1D,2D,3D,6D,7D,8D,9D,11D,12D,15D,16D,17D,18D.

What are the key properties of 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran?

9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran has a molecular weight of 1884.44 g/mol, XLogP of 40.39, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[9-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran-2-yl]carbazole;4-[4-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;10-[3-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 167602660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).