1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene

C190H122O2 — CID 158275555

About 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene

1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene (PubChem CID 158275555) has the molecular formula C190H122O2 and a molecular weight of 2477.31 g/mol. Its IUPAC name is 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene.

Molecular Properties

• Compound Name: 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene
• PubChem CID: 158275555
• Molecular Formula: C190H122O2
• Molecular Weight: 2477.31 g/mol
• Exact Mass: 2475.20
• IUPAC Name: 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene
• SMILES: [2H]c1c([2H])c([2H])c2c(-c3cc4oc5ccc6ccccc6c5c4c4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc5ccccc5c4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4cccc5ccccc45)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc4c(c3)oc3c5ccccc5c5ccccc5c43)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H]
• InChI: InChI=1S/2C40H24O.C38H26.2C36H24/c1-2-12-25(13-3-1)37-30-17-7-9-19-32(30)38(33-20-10-8-18-31(33)37)26-22-23-35-36(24-26)41-40-34-21-11-5-15-28(34)27-14-4-6-16-29(27)39(35)40;1-2-13-26(14-3-1)37-30-18-8-10-20-32(30)38(33-21-11-9-19-31(33)37)34-24-36-40(29-17-7-6-16-28(29)34)39-27-15-5-4-12-25(27)22-23-35(39)41-36;1-3-11-27(12-4-1)28-19-21-29(22-20-28)30-23-25-32(26-24-30)38-35-17-9-7-15-33(35)37(31-13-5-2-6-14-31)34-16-8-10-18-36(34)38;1-2-12-27(13-3-1)35-31-16-6-8-18-33(31)36(34-19-9-7-17-32(34)35)28-23-21-26(22-24-28)30-20-10-14-25-11-4-5-15-29(25)30;1-2-11-27(12-3-1)35-31-14-6-8-16-33(31)36(34-17-9-7-15-32(34)35)28-21-18-26(19-22-28)30-23-20-25-10-4-5-13-29(25)24-30/h2*1-24H;1-26H;2*1-24H/i7D,8D,9D,10D,17D,18D,19D,20D;8D,9D,10D,11D,18D,19D,20D,21D;7D,8D,9D,10D,15D,16D,17D,18D;6D,7D,8D,9D,16D,17D,18D,19D;6D,7D,8D,9D,14D,15D,16D,17D
• InChIKey: GJOHBORKSLYXIJ-AXRCWFMCSA-N
• XLogP: 54.02
• TPSA: 26.28 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 14
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2477.31
LogP ≤ 5	54.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene?

The IUPAC name of 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene (CID 158275555) is 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene.

What is the SMILES notation for 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene?

The canonical SMILES for 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene is [2H]c1c([2H])c([2H])c2c(-c3cc4oc5ccc6ccccc6c5c4c4ccccc34)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4ccc5ccccc5c4)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc(-c4cccc5ccccc45)cc3)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].[2H]c1c([2H])c([2H])c2c(-c3ccc4c(c3)oc3c5ccccc5c5ccccc5c43)c3c([2H])c([2H])c([2H])c([2H])c3c(-c3ccccc3)c2c1[2H].

What is the InChIKey of 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene?

The InChIKey is GJOHBORKSLYXIJ-AXRCWFMCSA-N. The full InChI is InChI=1S/2C40H24O.C38H26.2C36H24/c1-2-12-25(13-3-1)37-30-17-7-9-19-32(30)38(33-20-10-8-18-31(33)37)26-22-23-35-36(24-26)41-40-34-21-11-5-15-28(34)27-14-4-6-16-29(27)39(35)40;1-2-13-26(14-3-1)37-30-18-8-10-20-32(30)38(33-21-11-9-19-31(33)37)34-24-36-40(29-17-7-6-16-28(29)34)39-27-15-5-4-12-25(27)22-23-35(39)41-36;1-3-11-27(12-4-1)28-19-21-29(22-20-28)30-23-25-32(26-24-30)38-35-17-9-7-15-33(35)37(31-13-5-2-6-14-31)34-16-8-10-18-36(34)38;1-2-12-27(13-3-1)35-31-16-6-8-18-33(31)36(34-19-9-7-17-32(34)35)28-23-21-26(22-24-28)30-20-10-14-25-11-4-5-15-29(25)30;1-2-11-27(12-3-1)35-31-14-6-8-16-33(31)36(34-17-9-7-15-32(34)35)28-21-18-26(19-22-28)30-23-20-25-10-4-5-13-29(25)24-30/h2*1-24H;1-26H;2*1-24H/i7D,8D,9D,10D,17D,18D,19D,20D;8D,9D,10D,11D,18D,19D,20D,21D;7D,8D,9D,10D,15D,16D,17D,18D;6D,7D,8D,9D,16D,17D,18D,19D;6D,7D,8D,9D,14D,15D,16D,17D.

What are the key properties of 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene?

1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene has a molecular weight of 2477.31 g/mol, XLogP of 54.02, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;1,2,3,4,5,6,7,8-octadeuterio-9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;18-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;1,2,3,4,5,6,7,8-octadeuterio-9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene is sourced from PubChem (CID 158275555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).