2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran

C198H228O3 — CID 167658763

About 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran

2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran (PubChem CID 167658763) has the molecular formula C198H228O3 and a molecular weight of 2656.00 g/mol. Its IUPAC name is 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran.

Molecular Properties

• Compound Name: 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran
• PubChem CID: 167658763
• Molecular Formula: C198H228O3
• Molecular Weight: 2656.00 g/mol
• Exact Mass: 2653.77
• IUPAC Name: 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran
• SMILES: Cc1c(C)c(C)c(-c2c(C)c(C)c(-c3c(C)c(C)c(C)c(C)c3-c3c4c(C)c(C)c(C)c(C)c4c(-c4c(C)c(C)c5oc6c(C)c(C)c(C)c(C)c6c5c4C)c4c(C)c(C)c(C)c(C)c34)c(C)c2C)c(C)c1C.Cc1c(C)c(C)c(-c2c(C)c(C)c3c(C)c(-c4c5c(C)c(C)c(C)c(C)c5c(-c5c(C)c(C)c6oc7c(C)c(C)c(C)c(C)c7c6c5C)c5c(C)c(C)c(C)c(C)c45)c(C)c(C)c3c2C)c(C)c1C.Cc1c(C)c(C)c2c(oc3c(C)c(C)c(-c4c5c(C)c(C)c(C)c(C)c5c(-c5c(C)c(C)c6c(C)c(C)c(C)c(C)c6c5C)c5c(C)c(C)c(C)c(C)c45)c(C)c32)c1C
• InChI: InChI=1S/C72H84O.C68H78O.C58H66O/c1-29-30(2)40(12)57(41(13)31(29)3)58-49(21)51(23)59(52(24)50(58)22)61-42(14)32(4)33(5)43(15)62(61)70-65-46(18)36(8)34(6)44(16)63(65)69(64-45(17)35(7)37(9)47(19)66(64)70)60-53(25)55(27)72-68(56(60)28)67-48(20)38(10)39(11)54(26)71(67)73-72;1-27-28(2)36(10)53(37(11)29(27)3)54-43(17)44(18)56-51(25)57(46(20)45(19)55(56)50(54)24)65-59-38(12)30(4)32(6)40(14)61(59)66(62-41(15)33(7)31(5)39(13)60(62)65)58-47(21)49(23)68-64(52(58)26)63-42(16)34(8)35(9)48(22)67(63)69-68;1-23-24(2)32(10)46-43(21)47(39(17)38(16)45(46)31(23)9)55-49-33(11)25(3)27(5)35(13)51(49)56(52-36(14)28(6)26(4)34(12)50(52)55)48-40(18)42(20)58-54(44(48)22)53-37(15)29(7)30(8)41(19)57(53)59-58/h1-28H3;1-26H3;1-22H3
• InChIKey: RQMURBOXVXETEF-UHFFFAOYSA-N
• XLogP: 58.43
• TPSA: 39.42 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 9
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2656.00
LogP ≤ 5	58.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran?

The IUPAC name of 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran (CID 167658763) is 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran.

What is the SMILES notation for 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran?

The canonical SMILES for 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran is Cc1c(C)c(C)c(-c2c(C)c(C)c(-c3c(C)c(C)c(C)c(C)c3-c3c4c(C)c(C)c(C)c(C)c4c(-c4c(C)c(C)c5oc6c(C)c(C)c(C)c(C)c6c5c4C)c4c(C)c(C)c(C)c(C)c34)c(C)c2C)c(C)c1C.Cc1c(C)c(C)c(-c2c(C)c(C)c3c(C)c(-c4c5c(C)c(C)c(C)c(C)c5c(-c5c(C)c(C)c6oc7c(C)c(C)c(C)c(C)c7c6c5C)c5c(C)c(C)c(C)c(C)c45)c(C)c(C)c3c2C)c(C)c1C.Cc1c(C)c(C)c2c(oc3c(C)c(C)c(-c4c5c(C)c(C)c(C)c(C)c5c(-c5c(C)c(C)c6c(C)c(C)c(C)c(C)c6c5C)c5c(C)c(C)c(C)c(C)c45)c(C)c32)c1C.

What is the InChIKey of 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran?

The InChIKey is RQMURBOXVXETEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H84O.C68H78O.C58H66O/c1-29-30(2)40(12)57(41(13)31(29)3)58-49(21)51(23)59(52(24)50(58)22)61-42(14)32(4)33(5)43(15)62(61)70-65-46(18)36(8)34(6)44(16)63(65)69(64-45(17)35(7)37(9)47(19)66(64)70)60-53(25)55(27)72-68(56(60)28)67-48(20)38(10)39(11)54(26)71(67)73-72;1-27-28(2)36(10)53(37(11)29(27)3)54-43(17)44(18)56-51(25)57(46(20)45(19)55(56)50(54)24)65-59-38(12)30(4)32(6)40(14)61(59)66(62-41(15)33(7)31(5)39(13)60(62)65)58-47(21)49(23)68-64(52(58)26)63-42(16)34(8)35(9)48(22)67(63)69-68;1-23-24(2)32(10)46-43(21)47(39(17)38(16)45(46)31(23)9)55-49-33(11)25(3)27(5)35(13)51(49)56(52-36(14)28(6)26(4)34(12)50(52)55)48-40(18)42(20)58-54(44(48)22)53-37(15)29(7)30(8)41(19)57(53)59-58/h1-28H3;1-26H3;1-22H3.

What are the key properties of 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran?

2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran has a molecular weight of 2656.00 g/mol, XLogP of 58.43, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[10-(1,3,4,5,6,7,8-heptamethylnaphthalen-2-yl)-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran;1,2,3,4,6,7,9-heptamethyl-8-[1,2,3,4,5,6,7,8-octamethyl-10-[2,3,4,5-tetramethyl-6-[2,3,5,6-tetramethyl-4-(2,3,4,5,6-pentamethylphenyl)phenyl]phenyl]anthracen-9-yl]dibenzofuran;2-[10-[1,3,4,5,7,8-hexamethyl-6-(2,3,4,5,6-pentamethylphenyl)naphthalen-2-yl]-1,2,3,4,5,6,7,8-octamethylanthracen-9-yl]-1,3,4,6,7,8,9-heptamethyldibenzofuran is sourced from PubChem (CID 167658763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).