溴乙酸五氯苯酯
TL;DR: 溴乙酸五氯苯酯 (CAS 21219-23-8) is a chemical compound with molecular formula C8H2BrCl5O2 and molecular weight 383.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴乙酸五氯苯酯
(2,3,4,5,6-pentachlorophenyl) 2-bromoacetate
Also Known As: pentachlorophenyl bromoacetate, Acetic acid, bromo-, pentachlorophenyl ester, (2,3,4,5,6-pentachlorophenyl) 2-bromoacetate, RefChem:316569
| Molecular Formula | C8H2BrCl5O2 |
|---|---|
| Molecular Weight | 383.77 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.76807 |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 21219-23-8 |
|---|---|
| SMILES | C(C(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)Br |
| InChIKey | KLKJDOXPPVLZCE-UHFFFAOYSA-N |
Product Overview
溴乙酸五氯苯酯 (CAS 21219-23-8), with molecular formula C8H2BrCl5O2 and molecular weight 383.77 g/mol. IUPAC: (2,3,4,5,6-pentachlorophenyl) 2-bromoacetate.
Chemical Property Profile of 溴乙酸五氯苯酯
Property Insights of 溴乙酸五氯苯酯
The XLogP value of 5.6 indicates that 溴乙酸五氯苯酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 溴乙酸五氯苯酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 溴乙酸五氯苯酯 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 溴乙酸五氯苯酯?
The CAS number of 溴乙酸五氯苯酯 is 21219-23-8.
What is the molecular formula of 溴乙酸五氯苯酯?
The molecular formula of 溴乙酸五氯苯酯 is C8H2BrCl5O2.
What is the molecular weight of 溴乙酸五氯苯酯?
The molecular weight of 溴乙酸五氯苯酯 is 383.77 g/mol.
Where can I buy 溴乙酸五氯苯酯?
You can request a quote for 溴乙酸五氯苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴乙酸五氯苯酯?
Yes, KEHONG BIO provides custom synthesis services for 溴乙酸五氯苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.