Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) structure

Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)

TL;DR: Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) (CAS 7226-97-3) is a chemical compound with molecular formula C42H69B3N6Zr-2 and molecular weight 780.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)

Also Known As: IUPAC: (phenyl-tert-butylazanidyl-boranyl)-tert-butyl-azanide; Zirconium(+4) Cation

CAS: 7226-97-3
Molecular Formula C42H69B3N6Zr-2
Molecular Weight 780.49 g/mol
LogP 11.1761
Topological Polar Surface Area 84.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
Rotatable Bonds 9
Exact Mass 780.49097
Heavy Atoms 52
Complexity 1135.5568

Chemical Identifiers

CAS Number 7226-97-3
SMILES B(C1=CC=CC=C1)([N-]C(C)(C)C)[N-]C(C)(C)C.B(C1=CC=CC=C1)([N-]C(C)(C)C)[N-]C(C)(C)C.B(C1=CC=CC=C1)([N-]C(C)(C)C)[N-]C(C)(C)C.[Zr+4]

Product Overview

Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) (CAS 7226-97-3), with molecular formula C42H69B3N6Zr-2 and molecular weight 780.49 g/mol. IUPAC: tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+).

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)

XLogP
11.1761
TPSA (Topological Polar Surface Area)
84.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
Rotatable Bonds
9
Heavy Atoms
52
Complexity
1135.5568
Exact Mass
780.49097
Monoisotopic Mass
780.49097
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)

The XLogP value of 11.1761 indicates that Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+). Following Lipinski's Rule of Five, Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)?

The CAS number of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) is 7226-97-3.

What is the molecular formula of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)?

The molecular formula of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) is C42H69B3N6Zr-2.

What is the molecular weight of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)?

The molecular weight of Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) is 780.49 g/mol.

Where can I buy Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)?

You can request a quote for Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+)?

Yes, KEHONG BIO provides custom synthesis services for Tris(tert-butyl-[tert-butylazanidyl(phenyl)boranyl]azanide);zirconium(4+) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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