2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid
TL;DR: 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid (CAS 312587-09-0) is a chemical compound with molecular formula C11H13BrO3 and molecular weight 272.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-2,6-dimethylphenoxy)propanoic acid
Also Known As: 2-(4-bromo-2,6-dimethylphenoxy)propanoic acid, 3-(5-Ethyl-benzooxazol-2-yl)-phenylamine, 2-(4-bromo-2,6-dimethyl-phenoxy)propanoic Acid, 2-(4-bromo-2,6-dimethylphenoxy)propanoicacid, Z-0947
| Molecular Formula | C11H13BrO3 |
|---|---|
| Molecular Weight | 272.00 g/mol |
| LogP | 2.91784 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.00482 |
| Heavy Atoms | 15 |
| Complexity | 364.41458 |
Chemical Identifiers
| CAS Number | 312587-09-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OC(C)C(=O)O)C)Br |
Product Overview
2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid (CAS 312587-09-0), with molecular formula C11H13BrO3 and molecular weight 272.00 g/mol. IUPAC: 2-(4-bromo-2,6-dimethylphenoxy)propanoic acid.
Chemical Property Profile of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid
Property Insights of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid
The XLogP value of 2.91784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid has 1 hydrogen bond donor(s) and 2 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-(4-Bromo-2,6-dimethylphenoxy)propanoic acid?
The CAS number of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid is 312587-09-0.
What is the molecular formula of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid?
The molecular formula of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid is C11H13BrO3.
What is the molecular weight of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid?
The molecular weight of 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid is 272.00 g/mol.
Where can I buy 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid?
You can request a quote for 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromo-2,6-dimethylphenoxy)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.