7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine

C77H54N2 — CID 135193235

About 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine

7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 135193235) has the molecular formula C77H54N2 and a molecular weight of 1007.29 g/mol. Its IUPAC name is 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

• Compound Name: 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
• PubChem CID: 135193235
• Molecular Formula: C77H54N2
• Molecular Weight: 1007.29 g/mol
• Exact Mass: 1006.43
• IUPAC Name: 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
• SMILES: CC1(C)c2cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21
• InChI: InChI=1S/C77H54N2/c1-75(2)68-48-55(42-45-59(68)60-46-44-57(49-69(60)75)79-71-39-21-17-33-62(71)63-34-18-22-40-72(63)79)78(56-43-47-61-58-32-15-19-36-65(58)77(70(61)50-56,53-28-11-5-12-29-53)54-30-13-6-14-31-54)73-41-23-38-67-74(73)64-35-16-20-37-66(64)76(67,51-24-7-3-8-25-51)52-26-9-4-10-27-52/h3-50H,1-2H3
• InChIKey: GULVUCGUANUPGS-UHFFFAOYSA-N
• XLogP: 19.29
• TPSA: 8.17 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1007.29
LogP ≤ 5	19.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine?

The IUPAC name of 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine (CID 135193235) is 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine.

What is the SMILES notation for 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine?

The canonical SMILES for 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine is CC1(C)c2cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.

What is the InChIKey of 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine?

The InChIKey is GULVUCGUANUPGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C77H54N2/c1-75(2)68-48-55(42-45-59(68)60-46-44-57(49-69(60)75)79-71-39-21-17-33-62(71)63-34-18-22-40-72(63)79)78(56-43-47-61-58-32-15-19-36-65(58)77(70(61)50-56,53-28-11-5-12-29-53)54-30-13-6-14-31-54)73-41-23-38-67-74(73)64-35-16-20-37-66(64)76(67,51-24-7-3-8-25-51)52-26-9-4-10-27-52/h3-50H,1-2H3.

What are the key properties of 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine?

7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine has a molecular weight of 1007.29 g/mol, XLogP of 19.29, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 135193235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).