4-(2-Bromo-4-tert-butylphenoxy)butanoic acid
TL;DR: 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid (CAS 879643-07-9) is a chemical compound with molecular formula C14H19BrO3 and molecular weight 314.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-bromo-4-tert-butylphenoxy)butanoic acid
Also Known As: 4-(2-bromo-4-tert-butylphenoxy)butanoic acid, 4-(2-bromo-4-tert-butylphenoxy)butanoicacid, 4-(2-bromo-4-tert-butyl-phenoxy)butanoic Acid, 4-[4-(tert-butyl)-2-bromophenoxy]butanoic acid, AS-871/43475808
| Molecular Formula | C14H19BrO3 |
|---|---|
| Molecular Weight | 314.05 g/mol |
| LogP | 3.9902 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.05176 |
| Heavy Atoms | 18 |
| Complexity | 421.53754 |
Chemical Identifiers
| CAS Number | 879643-07-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)O)Br |
Product Overview
4-(2-Bromo-4-tert-butylphenoxy)butanoic acid (CAS 879643-07-9), with molecular formula C14H19BrO3 and molecular weight 314.05 g/mol. IUPAC: 4-(2-bromo-4-tert-butylphenoxy)butanoic acid.
Chemical Property Profile of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid
Property Insights of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid
The XLogP value of 3.9902 indicates that 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid?
The CAS number of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid is 879643-07-9.
What is the molecular formula of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid?
The molecular formula of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid is C14H19BrO3.
What is the molecular weight of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid?
The molecular weight of 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid is 314.05 g/mol.
Where can I buy 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid?
You can request a quote for 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Bromo-4-tert-butylphenoxy)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.