9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene

C175H114O4 — CID 161052964

About 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene

9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene (PubChem CID 161052964) has the molecular formula C175H114O4 and a molecular weight of 2280.83 g/mol. Its IUPAC name is 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene.

Molecular Properties

• Compound Name: 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
• PubChem CID: 161052964
• Molecular Formula: C175H114O4
• Molecular Weight: 2280.83 g/mol
• Exact Mass: 2278.87
• IUPAC Name: 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
• SMILES: CC1(C)c2ccccc2-c2cc3c(cc21)-c1c(cc(-c2c4ccccc4c(-c4ccccc4)c4ccccc24)c2ccccc12)C3(C)C.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3c4ccc4c5cccc(-c6ccccc6)c5oc43)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3c4ccc4c5ccccc5oc43)c3ccccc23)cc1
• InChI: InChI=1S/C48H36.C45H30.C44H26O2.C38H22O2/c1-47(2)40-25-15-14-19-31(40)37-26-42-39(28-41(37)47)46-32-20-9-8-18-30(32)38(27-43(46)48(42,3)4)45-35-23-12-10-21-33(35)44(29-16-6-5-7-17-29)34-22-11-13-24-36(34)45;1-4-16-31(17-5-1)43-37-23-10-12-25-39(37)44(40-26-13-11-24-38(40)43)32-28-29-36-35-22-14-15-27-41(35)45(42(36)30-32,33-18-6-2-7-19-33)34-20-8-3-9-21-34;1-3-12-27(13-4-1)30-20-11-21-36-38-25-24-37-31-23-22-29(26-39(31)45-43(37)44(38)46-42(30)36)41-34-18-9-7-16-32(34)40(28-14-5-2-6-15-28)33-17-8-10-19-35(33)41;1-2-10-23(11-3-1)35-27-13-4-6-15-29(27)36(30-16-7-5-14-28(30)35)24-18-19-26-32-21-20-31-25-12-8-9-17-33(25)39-37(31)38(32)40-34(26)22-24/h5-28H,1-4H3;1-30H;1-26H;1-22H
• InChIKey: UCJMPHGHFJFJCW-UHFFFAOYSA-N
• XLogP: 48.70
• TPSA: 52.56 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 179
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2280.83
LogP ≤ 5	48.70
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-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene?

The IUPAC name of 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene (CID 161052964) is 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene.

What is the SMILES notation for 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene?

The canonical SMILES for 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene is CC1(C)c2ccccc2-c2cc3c(cc21)-c1c(cc(-c2c4ccccc4c(-c4ccccc4)c4ccccc24)c2ccccc12)C3(C)C.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3c4ccc4c5cccc(-c6ccccc6)c5oc43)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3c4ccc4c5ccccc5oc43)c3ccccc23)cc1.

What is the InChIKey of 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene?

The InChIKey is UCJMPHGHFJFJCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36.C45H30.C44H26O2.C38H22O2/c1-47(2)40-25-15-14-19-31(40)37-26-42-39(28-41(37)47)46-32-20-9-8-18-30(32)38(27-43(46)48(42,3)4)45-35-23-12-10-21-33(35)44(29-16-6-5-7-17-29)34-22-11-13-24-36(34)45;1-4-16-31(17-5-1)43-37-23-10-12-25-39(37)44(40-26-13-11-24-38(40)43)32-28-29-36-35-22-14-15-27-41(35)45(42(36)30-32,33-18-6-2-7-19-33)34-20-8-3-9-21-34;1-3-12-27(13-4-1)30-20-11-21-36-38-25-24-37-31-23-22-29(26-39(31)45-43(37)44(38)46-42(30)36)41-34-18-9-7-16-32(34)40(28-14-5-2-6-15-28)33-17-8-10-19-35(33)41;1-2-10-23(11-3-1)35-27-13-4-6-15-29(27)36(30-16-7-5-14-28(30)35)24-18-19-26-32-21-20-31-25-12-8-9-17-33(25)39-37(31)38(32)40-34(26)22-24/h5-28H,1-4H3;1-30H;1-26H;1-22H.

What are the key properties of 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene?

9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene has a molecular weight of 2280.83 g/mol, XLogP of 48.70, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(9,9-diphenylfluoren-2-yl)-10-phenylanthracene;6-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;5-phenyl-17-(10-phenylanthracen-9-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene;12,12,22,22-tetramethyl-9-(10-phenylanthracen-9-yl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene is sourced from PubChem (CID 161052964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).