2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane

C96H70BClN6O7 — CID 165074197

About 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane

2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane (PubChem CID 165074197) has the molecular formula C96H70BClN6O7 and a molecular weight of 1465.92 g/mol. Its IUPAC name is 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane.

Molecular Properties

• Compound Name: 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane
• PubChem CID: 165074197
• Molecular Formula: C96H70BClN6O7
• Molecular Weight: 1465.92 g/mol
• Exact Mass: 1464.51
• IUPAC Name: 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane
• SMILES: C1CCOC1.CC1(C)OB(c2ccc(-c3cccc4c3oc3ccccc34)c3oc4cc5ccccc5cc4c23)OC1(C)C.Clc1nc(-c2ccccc2)nc(-c2ccccc2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5c4oc4ccccc45)c4oc5cc6ccccc6cc5c34)n2)cc1
• InChI: InChI=1S/C43H25N3O2.C34H27BO4.C15H10ClN3.C4H8O/c1-3-12-26(13-4-1)41-44-42(27-14-5-2-6-15-27)46-43(45-41)34-23-22-33(32-20-11-19-31-30-18-9-10-21-36(30)47-39(31)32)40-38(34)35-24-28-16-7-8-17-29(28)25-37(35)48-40;1-33(2)34(3,4)39-35(38-33)27-17-16-25(24-14-9-13-23-22-12-7-8-15-28(22)36-31(23)24)32-30(27)26-18-20-10-5-6-11-21(20)19-29(26)37-32;16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12;1-2-4-5-3-1/h1-25H;5-19H,1-4H3;1-10H;1-4H2
• InChIKey: UAMCFEXUVMSFQH-UHFFFAOYSA-N
• XLogP: 24.75
• TPSA: 157.59 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 8
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1465.92
LogP ≤ 5	24.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane?

The IUPAC name of 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane (CID 165074197) is 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane.

What is the SMILES notation for 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane?

The canonical SMILES for 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane is C1CCOC1.CC1(C)OB(c2ccc(-c3cccc4c3oc3ccccc34)c3oc4cc5ccccc5cc4c23)OC1(C)C.Clc1nc(-c2ccccc2)nc(-c2ccccc2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5c4oc4ccccc45)c4oc5cc6ccccc6cc5c34)n2)cc1.

What is the InChIKey of 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane?

The InChIKey is UAMCFEXUVMSFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H25N3O2.C34H27BO4.C15H10ClN3.C4H8O/c1-3-12-26(13-4-1)41-44-42(27-14-5-2-6-15-27)46-43(45-41)34-23-22-33(32-20-11-19-31-30-18-9-10-21-36(30)47-39(31)32)40-38(34)35-24-28-16-7-8-17-29(28)25-37(35)48-40;1-33(2)34(3,4)39-35(38-33)27-17-16-25(24-14-9-13-23-22-12-7-8-15-28(22)36-31(23)24)32-30(27)26-18-20-10-5-6-11-21(20)19-29(26)37-32;16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12;1-2-4-5-3-1/h1-25H;5-19H,1-4H3;1-10H;1-4H2.

What are the key properties of 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane?

2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane has a molecular weight of 1465.92 g/mol, XLogP of 24.75, 8 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylnaphtho[2,3-b][1]benzofuran-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;oxolane is sourced from PubChem (CID 165074197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).