2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid
TL;DR: 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid (CAS 445002-70-0) is a chemical compound with molecular formula C11H12BrNO5 and molecular weight 316.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid
Also Known As: {2-bromo-6-ethoxy-4-[(hydroxyimino)methyl]phenoxy}acetic acid, 2-[2-bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid, {2-bromo-6-ethoxy-4-[(E)-(hydroxyimino)methyl]phenoxy}acetic acid
| Molecular Formula | C11H12BrNO5 |
|---|---|
| Molecular Weight | 316.99 g/mol |
| LogP | 2.1193 |
| Topological Polar Surface Area | 88.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.9899 |
| Heavy Atoms | 18 |
| Complexity | 460.99194 |
Chemical Identifiers
| CAS Number | 445002-70-0 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=NO)Br)OCC(=O)O |
Product Overview
2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid (CAS 445002-70-0), with molecular formula C11H12BrNO5 and molecular weight 316.99 g/mol. IUPAC: 2-[2-bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid.
Chemical Property Profile of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid
Property Insights of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid
The XLogP value of 2.1193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid. The TPSA of 88.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid. Following Lipinski's Rule of Five, 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid has 2 hydrogen bond donor(s) and 5 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 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid?
The CAS number of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid is 445002-70-0.
What is the molecular formula of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid?
The molecular formula of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid is C11H12BrNO5.
What is the molecular weight of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid?
The molecular weight of 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid is 316.99 g/mol.
Where can I buy 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid?
You can request a quote for 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-Bromo-6-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.