2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene

C85H54BrF12N7 — CID 159590846

About 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene

2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene (PubChem CID 159590846) has the molecular formula C85H54BrF12N7 and a molecular weight of 1481.30 g/mol. Its IUPAC name is 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene.

Molecular Properties

• Compound Name: 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene
• PubChem CID: 159590846
• Molecular Formula: C85H54BrF12N7
• Molecular Weight: 1481.30 g/mol
• Exact Mass: 1479.34
• IUPAC Name: 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene
• SMILES: FC(F)(F)C(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)(c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(F)(F)F.FC(F)(F)C(c1ccc(Br)cc1)(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)C(F)(F)F.c1ccc2c(c1)Cc1ccccc1-2
• InChI: InChI=1S/C42H26F6N4.C30H18BrF6N3.C13H10/c43-41(44,45)40(42(46,47)48,31-23-25-32(26-24-31)52-35-17-9-7-15-33(35)34-16-8-10-18-36(34)52)30-21-19-29(20-22-30)39-50-37(27-11-3-1-4-12-27)49-38(51-39)28-13-5-2-6-14-28;31-24-17-15-23(16-18-24)28(29(32,33)34,30(35,36)37)22-13-11-21(12-14-22)27-39-25(19-7-3-1-4-8-19)38-26(40-27)20-9-5-2-6-10-20;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-26H;1-18H;1-8H,9H2
• InChIKey: MKFGXLKIXNHENI-UHFFFAOYSA-N
• XLogP: 23.68
• TPSA: 82.27 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 11
• Heavy Atoms: 105
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1481.30
LogP ≤ 5	23.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene?

The IUPAC name of 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene (CID 159590846) is 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene.

What is the SMILES notation for 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene?

The canonical SMILES for 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene is FC(F)(F)C(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)(c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(F)(F)F.FC(F)(F)C(c1ccc(Br)cc1)(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)C(F)(F)F.c1ccc2c(c1)Cc1ccccc1-2.

What is the InChIKey of 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene?

The InChIKey is MKFGXLKIXNHENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26F6N4.C30H18BrF6N3.C13H10/c43-41(44,45)40(42(46,47)48,31-23-25-32(26-24-31)52-35-17-9-7-15-33(35)34-16-8-10-18-36(34)52)30-21-19-29(20-22-30)39-50-37(27-11-3-1-4-12-27)49-38(51-39)28-13-5-2-6-14-28;31-24-17-15-23(16-18-24)28(29(32,33)34,30(35,36)37)22-13-11-21(12-14-22)27-39-25(19-7-3-1-4-8-19)38-26(40-27)20-9-5-2-6-10-20;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-26H;1-18H;1-8H,9H2.

What are the key properties of 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene?

2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene has a molecular weight of 1481.30 g/mol, XLogP of 23.68, 11 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-4,6-diphenyl-1,3,5-triazine;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]carbazole;9H-fluorene is sourced from PubChem (CID 159590846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).