3-Tert-butyl-4-hydroxyphenyl phenylacetate
TL;DR: 3-Tert-butyl-4-hydroxyphenyl phenylacetate (CAS 92944-24-6) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-tert-butyl-4-hydroxyphenyl) 2-phenylacetate
Also Known As: 3-tert-butyl-4-hydroxyphenyl phenylacetate, (3-tert-butyl-4-hydroxyphenyl) 2-phenylacetate, 2-methyl-8-trimethylsilylocta-1,6-dien-3-ol, Benzeneacetic acid, 3-(1,1-dimethylethyl)-4-hydroxyphenyl ester
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 3.8378 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 624.65686 |
Chemical Identifiers
| CAS Number | 92944-24-6 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=CC(=C1)OC(=O)CC2=CC=CC=C2)O |
Product Overview
3-Tert-butyl-4-hydroxyphenyl phenylacetate (CAS 92944-24-6), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: (3-tert-butyl-4-hydroxyphenyl) 2-phenylacetate.
Chemical Property Profile of 3-Tert-butyl-4-hydroxyphenyl phenylacetate
Property Insights of 3-Tert-butyl-4-hydroxyphenyl phenylacetate
The XLogP value of 3.8378 indicates that 3-Tert-butyl-4-hydroxyphenyl phenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 3-Tert-butyl-4-hydroxyphenyl phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Tert-butyl-4-hydroxyphenyl phenylacetate has 1 hydrogen bond donor(s) and 3 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 3-Tert-butyl-4-hydroxyphenyl phenylacetate?
The CAS number of 3-Tert-butyl-4-hydroxyphenyl phenylacetate is 92944-24-6.
What is the molecular formula of 3-Tert-butyl-4-hydroxyphenyl phenylacetate?
The molecular formula of 3-Tert-butyl-4-hydroxyphenyl phenylacetate is C18H20O3.
What is the molecular weight of 3-Tert-butyl-4-hydroxyphenyl phenylacetate?
The molecular weight of 3-Tert-butyl-4-hydroxyphenyl phenylacetate is 284.14 g/mol.
Where can I buy 3-Tert-butyl-4-hydroxyphenyl phenylacetate?
You can request a quote for 3-Tert-butyl-4-hydroxyphenyl phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Tert-butyl-4-hydroxyphenyl phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Tert-butyl-4-hydroxyphenyl phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.