![2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one structure](/static/products/1438/14386-64-2.webp)
2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one
TL;DR: 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one (CAS 14386-64-2) is a chemical compound with molecular formula C16H23BrO2 and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone
Also Known As: 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one, 2-Bromo-1-(3,5-di-tert-butyl-4-hydroxyphenyl)ethanone, 2-Bromo-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone, 3-Methoxyisoxazole-5-carboxylic acid, 3,5-di-t-butyl-4-hydroxyphenacyl bromide
| Molecular Formula | C16H23BrO2 |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.08813 |
| Heavy Atoms | 19 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 14386-64-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CBr |
| InChIKey | UYPXQSLSPUBZQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one (CAS 14386-64-2), with molecular formula C16H23BrO2 and molecular weight 326.09 g/mol. IUPAC: 2-bromo-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone.
Chemical Property Profile of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one
Property Insights of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one
The XLogP value of 5.4 indicates that 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one has 1 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 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one?
The CAS number of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one is 14386-64-2.
What is the molecular formula of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one?
The molecular formula of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one is C16H23BrO2.
What is the molecular weight of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one?
The molecular weight of 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one is 326.09 g/mol.
Where can I buy 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one?
You can request a quote for 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-[3,5-di(tert-butyl)-4-hydroxyphenyl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.