1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene

C114H80F12N8 — CID 157137734

IUPAC1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene
SMILESCc1cccc2c1Cc1c(C)cccc1-2.Cc1cccc2c3cccc(C)c3n(-c3ccc(C(c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)(C(F)(F)F)C(F)(F)F)cc3)c12.FC(F)(F)C(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)(c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(F)(F)F.c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C44H30F6N4.C42H26F6N4.C15H14.C13H10/c1-27-11-9-17-35-36-18-10-12-28(2)38(36)54(37(27)35)34-25-23-33(24-26-34)42(43(45,46)47,44(48,49)50)32-21-19-31(20-22-32)41-52-39(29-13-5-3-6-14-29)51-40(53-41)30-15-7-4-8-16-30;43-41(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;1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h3-26H,1-2H3;1-26H;3-8H,9H2,1-2H3;1-8H,9H2
InChIKeyAJVBMISRJIABBT-UHFFFAOYSA-N
MW1789.93 g/mol
LogP30.51
Rot. Bonds12

About 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene

1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene (PubChem CID 157137734) has the molecular formula C114H80F12N8 and a molecular weight of 1789.93 g/mol. Its IUPAC name is 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene.

Molecular Properties

Compound Name1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene
PubChem CID157137734
Molecular FormulaC114H80F12N8
Molecular Weight1789.93 g/mol
Exact Mass1788.63
IUPAC Name1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene
SMILESCc1cccc2c1Cc1c(C)cccc1-2.Cc1cccc2c3cccc(C)c3n(-c3ccc(C(c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)(C(F)(F)F)C(F)(F)F)cc3)c12.FC(F)(F)C(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)(c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(F)(F)F.c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C44H30F6N4.C42H26F6N4.C15H14.C13H10/c1-27-11-9-17-35-36-18-10-12-28(2)38(36)54(37(27)35)34-25-23-33(24-26-34)42(43(45,46)47,44(48,49)50)32-21-19-31(20-22-32)41-52-39(29-13-5-3-6-14-29)51-40(53-41)30-15-7-4-8-16-30;43-41(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;1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h3-26H,1-2H3;1-26H;3-8H,9H2,1-2H3;1-8H,9H2
InChIKeyAJVBMISRJIABBT-UHFFFAOYSA-N
XLogP30.51
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms134
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001789.93
LogP ≤ 530.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene?
The IUPAC name of 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene (CID 157137734) is 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene.
What is the SMILES notation for 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene?
The canonical SMILES for 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene is Cc1cccc2c1Cc1c(C)cccc1-2.Cc1cccc2c3cccc(C)c3n(-c3ccc(C(c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)(C(F)(F)F)C(F)(F)F)cc3)c12.FC(F)(F)C(c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)(c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(F)(F)F.c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene?
The InChIKey is AJVBMISRJIABBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30F6N4.C42H26F6N4.C15H14.C13H10/c1-27-11-9-17-35-36-18-10-12-28(2)38(36)54(37(27)35)34-25-23-33(24-26-34)42(43(45,46)47,44(48,49)50)32-21-19-31(20-22-32)41-52-39(29-13-5-3-6-14-29)51-40(53-41)30-15-7-4-8-16-30;43-41(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;1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-14(10)12;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h3-26H,1-2H3;1-26H;3-8H,9H2,1-2H3;1-8H,9H2.
What are the key properties of 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene?
1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene has a molecular weight of 1789.93 g/mol, XLogP of 30.51, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethyl-9H-fluorene;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;9-[4-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenyl]-1,8-dimethylcarbazole;9H-fluorene is sourced from PubChem (CID 157137734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).