2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine

C88H62N6 — CID 166980142

About 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine

2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine (PubChem CID 166980142) has the molecular formula C88H62N6 and a molecular weight of 1203.51 g/mol. Its IUPAC name is 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine
• PubChem CID: 166980142
• Molecular Formula: C88H62N6
• Molecular Weight: 1203.51 g/mol
• Exact Mass: 1202.50
• IUPAC Name: 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine
• SMILES: Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3cc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc(-c7ccc(-c8nc(-c9cccc(-c%10ccccc%10)c9)nc(-c9ccc%10c(c9)C(C)(C)c9cc%11ccccc%11cc9-%10)n8)cc7)cc6)cc5)n4)ccc32)cc1
• InChI: InChI=1S/C88H62N6/c1-55-26-44-71(45-27-55)88(72-46-28-56(2)29-47-72)77-25-14-13-24-73(77)75-52-69(43-49-78(75)88)85-90-81(62-18-9-6-10-19-62)89-82(92-85)63-38-34-60(35-39-63)58-30-32-59(33-31-58)61-36-40-64(41-37-61)83-91-84(68-23-15-22-65(50-68)57-16-7-5-8-17-57)94-86(93-83)70-42-48-74-76-51-66-20-11-12-21-67(66)53-80(76)87(3,4)79(74)54-70/h5-54H,1-4H3
• InChIKey: QEEJRUYZJKGFPP-UHFFFAOYSA-N
• XLogP: 21.50
• TPSA: 77.34 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 11
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1203.51
LogP ≤ 5	21.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine?

The IUPAC name of 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine (CID 166980142) is 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine.

What is the SMILES notation for 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine?

The canonical SMILES for 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine is Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3cc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc(-c7ccc(-c8nc(-c9cccc(-c%10ccccc%10)c9)nc(-c9ccc%10c(c9)C(C)(C)c9cc%11ccccc%11cc9-%10)n8)cc7)cc6)cc5)n4)ccc32)cc1.

What is the InChIKey of 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine?

The InChIKey is QEEJRUYZJKGFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H62N6/c1-55-26-44-71(45-27-55)88(72-46-28-56(2)29-47-72)77-25-14-13-24-73(77)75-52-69(43-49-78(75)88)85-90-81(62-18-9-6-10-19-62)89-82(92-85)63-38-34-60(35-39-63)58-30-32-59(33-31-58)61-36-40-64(41-37-61)83-91-84(68-23-15-22-65(50-68)57-16-7-5-8-17-57)94-86(93-83)70-42-48-74-76-51-66-20-11-12-21-67(66)53-80(76)87(3,4)79(74)54-70/h5-54H,1-4H3.

What are the key properties of 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine?

2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine has a molecular weight of 1203.51 g/mol, XLogP of 21.50, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9,9-bis(4-methylphenyl)fluoren-3-yl]-4-[4-[4-[4-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 166980142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).