4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene structure

4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene

TL;DR: 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene (CAS 69919-18-2) is a chemical compound with molecular formula C12H14Br3Cl2O3P and molecular weight 543.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

4-tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene

Also Known As: 4-TERT-BUTYL-2-CHLOROPHENYL-2,2,2-TRIBROMOETHYLPHOSPHOROCHLORIDATE, 4-tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene, 2-chloro-1-(chloro-(2,2,2-tribromoethoxy)phosphoryl)oxy-4-tert-butyl-benzene

CAS: 69919-18-2
Molecular Formula C12H14Br3Cl2O3P
Molecular Weight 543.76 g/mol
LogP 7.2183
Topological Polar Surface Area 35.53 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 543.76074
Heavy Atoms 21
Complexity 555.6591

Chemical Identifiers

CAS Number 69919-18-2
SMILES CC(C)(C)C1=CC(=C(C=C1)OP(=O)(OCC(Br)(Br)Br)Cl)Cl

Product Overview

4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene (CAS 69919-18-2), with molecular formula C12H14Br3Cl2O3P and molecular weight 543.76 g/mol. IUPAC: 4-tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene.

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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 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene

XLogP
7.2183
TPSA (Topological Polar Surface Area)
35.53
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
21
Complexity
555.6591
Exact Mass
543.76074
Monoisotopic Mass
545.7587
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 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene

The XLogP value of 7.2183 indicates that 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene has 0 hydrogen bond donor(s) and 3 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 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene?

The CAS number of 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene is 69919-18-2.

What is the molecular formula of 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene?

The molecular formula of 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene is C12H14Br3Cl2O3P.

What is the molecular weight of 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene?

The molecular weight of 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene is 543.76 g/mol.

Where can I buy 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene?

You can request a quote for 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene?

Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-2-chloro-1-[chloro(2,2,2-tribromoethoxy)phosphoryl]oxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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