![4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate structure](/static/products/444/444151-31-9.png)
4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate
TL;DR: 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate (CAS 444151-31-9) is a chemical compound with molecular formula C22H21BrO3 and molecular weight 412.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl) 2-(1-bromonaphthalen-2-yl)oxyacetate
Also Known As: 4-tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate, AN-329/40887399, (4-tert-butylphenyl) 2-(1-bromonaphthalen-2-yl)oxyacetate, 4-(tert-butyl)phenyl 2-(1-bromo-2-naphthyloxy)acetate, 4-tert-butylphenyl [(1-bromonaphthalen-2-yl)oxy]acetate
| Molecular Formula | C22H21BrO3 |
|---|---|
| Molecular Weight | 412.07 g/mol |
| LogP | 5.8842 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.0674 |
| Heavy Atoms | 26 |
| Complexity | 924.2654 |
Chemical Identifiers
| CAS Number | 444151-31-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OC(=O)COC2=C(C3=CC=CC=C3C=C2)Br |
Product Overview
4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate (CAS 444151-31-9), with molecular formula C22H21BrO3 and molecular weight 412.07 g/mol. IUPAC: (4-tert-butylphenyl) 2-(1-bromonaphthalen-2-yl)oxyacetate.
Chemical Property Profile of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate
Property Insights of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate
The XLogP value of 5.8842 indicates that 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate 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-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate 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 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate?
The CAS number of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate is 444151-31-9.
What is the molecular formula of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate?
The molecular formula of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate is C22H21BrO3.
What is the molecular weight of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate?
The molecular weight of 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate is 412.07 g/mol.
Where can I buy 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate?
You can request a quote for 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butylphenyl [(1-bromo-2-naphthyl)oxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.