[5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid
TL;DR: [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid (CAS 678147-49-4) is a chemical compound with molecular formula C10H11BrO5 and molecular weight 289.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid
Also Known As: 2-[5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid, (5-Bromo-4-hydroxymethyl-2-methoxy-phenoxy)-acetic acid, [5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid, 2-(5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy)acetic acid, 2-[5-bromo-4-(hydroxymethyl)-2-methoxy-phenoxy]acetic Acid
| Molecular Formula | C10H11BrO5 |
|---|---|
| Molecular Weight | 289.98 g/mol |
| LogP | 1.4134 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.979 |
| Heavy Atoms | 16 |
| Complexity | 391.04092 |
Chemical Identifiers
| CAS Number | 678147-49-4 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)CO)Br)OCC(=O)O |
Product Overview
[5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid (CAS 678147-49-4), with molecular formula C10H11BrO5 and molecular weight 289.98 g/mol. IUPAC: 2-[5-bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid.
Chemical Property Profile of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid
Property Insights of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid
The XLogP value of 1.4134 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid. The TPSA of 75.99 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid. Following Lipinski's Rule of Five, [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid has 2 hydrogen bond donor(s) and 4 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 [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid?
The CAS number of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid is 678147-49-4.
What is the molecular formula of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid?
The molecular formula of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid is C10H11BrO5.
What is the molecular weight of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid?
The molecular weight of [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid is 289.98 g/mol.
Where can I buy [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid?
You can request a quote for [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [5-Bromo-4-(hydroxymethyl)-2-methoxyphenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.