phenol, pentabromo-, aluminum salt
TL;DR: phenol, pentabromo-, aluminum salt (CAS 68084-29-7) is a chemical compound with molecular formula C18AlBr15O3 and molecular weight 1474.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aluminum tris(2,3,4,5,6-pentabromophenolate)
Also Known As: Aluminum pentabromophenoxide, Phenol, pentabromo-, aluminum salt, C6HBr5O.1/3Al, C6-H-Br5-O.1/3Al, N-(3-methylisoxazol-5-yl)acetamide
| Molecular Formula | C18AlBr15O3 |
|---|---|
| Molecular Weight | 1474.74 g/mol |
| LogP | 13.34 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 1488.727 |
| Heavy Atoms | 37 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 68084-29-7 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].[Al+3] |
| InChIKey | QDYHTWOQGFDCMO-UHFFFAOYSA-K |
Product Overview
phenol, pentabromo-, aluminum salt (CAS 68084-29-7), with molecular formula C18AlBr15O3 and molecular weight 1474.74 g/mol. IUPAC: aluminum tris(2,3,4,5,6-pentabromophenolate).
Chemical Property Profile of phenol, pentabromo-, aluminum salt
Property Insights of phenol, pentabromo-, aluminum salt
The XLogP value of 13.34 indicates that phenol, pentabromo-, aluminum salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for phenol, pentabromo-, aluminum salt. Following Lipinski's Rule of Five, phenol, pentabromo-, aluminum salt has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of phenol, pentabromo-, aluminum salt?
The CAS number of phenol, pentabromo-, aluminum salt is 68084-29-7.
What is the molecular formula of phenol, pentabromo-, aluminum salt?
The molecular formula of phenol, pentabromo-, aluminum salt is C18AlBr15O3.
What is the molecular weight of phenol, pentabromo-, aluminum salt?
The molecular weight of phenol, pentabromo-, aluminum salt is 1474.74 g/mol.
Where can I buy phenol, pentabromo-, aluminum salt?
You can request a quote for phenol, pentabromo-, aluminum salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenol, pentabromo-, aluminum salt?
Yes, KEHONG BIO provides custom synthesis services for phenol, pentabromo-, aluminum salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.