2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene

C105H66ClN7O2 — CID 162204009

About 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene

2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene (PubChem CID 162204009) has the molecular formula C105H66ClN7O2 and a molecular weight of 1493.18 g/mol. Its IUPAC name is 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene.

Molecular Properties

• Compound Name: 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene
• PubChem CID: 162204009
• Molecular Formula: C105H66ClN7O2
• Molecular Weight: 1493.18 g/mol
• Exact Mass: 1491.50
• IUPAC Name: 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene
• SMILES: Clc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c1-2.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3-c3cccc(-n5c6ccccc6c6ccccc65)c3C43c4ccccc4Oc4ccccc43)n2)cc1.c1ccc2c(c1)Cc1ccccc1-2
• InChI: InChI=1S/C52H32N4O.C40H24ClN3O.C13H10/c1-3-17-33(18-4-1)49-53-50(34-19-5-2-6-20-34)55-51(54-49)38-24-15-27-41-47(38)37-23-16-30-44(56-42-28-11-7-21-35(42)36-22-8-12-29-43(36)56)48(37)52(41)39-25-9-13-31-45(39)57-46-32-14-10-26-40(46)52;41-27-22-23-28-33(24-27)40(30-17-7-9-20-34(30)45-35-21-10-8-18-31(35)40)32-19-11-16-29(36(28)32)39-43-37(25-12-3-1-4-13-25)42-38(44-39)26-14-5-2-6-15-26;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-32H;1-24H;1-8H,9H2
• InChIKey: ZRYLPFMYNFOAOI-UHFFFAOYSA-N
• XLogP: 25.69
• TPSA: 100.73 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 7
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1493.18
LogP ≤ 5	25.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene?

The IUPAC name of 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene (CID 162204009) is 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene.

What is the SMILES notation for 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene?

The canonical SMILES for 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene is Clc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c1-2.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3-c3cccc(-n5c6ccccc6c6ccccc65)c3C43c4ccccc4Oc4ccccc43)n2)cc1.c1ccc2c(c1)Cc1ccccc1-2.

What is the InChIKey of 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene?

The InChIKey is ZRYLPFMYNFOAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4O.C40H24ClN3O.C13H10/c1-3-17-33(18-4-1)49-53-50(34-19-5-2-6-20-34)55-51(54-49)38-24-15-27-41-47(38)37-23-16-30-44(56-42-28-11-7-21-35(42)36-22-8-12-29-43(36)56)48(37)52(41)39-25-9-13-31-45(39)57-46-32-14-10-26-40(46)52;41-27-22-23-28-33(24-27)40(30-17-7-9-20-34(30)45-35-21-10-8-18-31(35)40)32-19-11-16-29(36(28)32)39-43-37(25-12-3-1-4-13-25)42-38(44-39)26-14-5-2-6-15-26;1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-32H;1-24H;1-8H,9H2.

What are the key properties of 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene?

2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene has a molecular weight of 1493.18 g/mol, XLogP of 25.69, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(7-chlorospiro[fluorene-9,9'-xanthene]-4-yl)-4,6-diphenyl-1,3,5-triazine;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]carbazole;9H-fluorene is sourced from PubChem (CID 162204009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).