2-((4-Bromonaphthalen-1-yl)oxy)acetic acid
TL;DR: 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid (CAS 82746-69-8) is a chemical compound with molecular formula C12H9BrO3 and molecular weight 279.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromonaphthalen-1-yl)oxyacetic acid
Also Known As: 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid, 2-(4-bromonaphthalen-1-yl)oxyacetic Acid, 2-(4-broMonaphthalen-1-yloxy)acetic acid, 2-[(4-Bromo-1-naphthyl)oxy]acetic acid, 2-(4-bromonaphthyloxy)acetic acid
| Molecular Formula | C12H9BrO3 |
|---|---|
| Molecular Weight | 279.97 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.9735 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 82746-69-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2Br)OCC(=O)O |
| InChIKey | HAGPEOVHVBDKNG-UHFFFAOYSA-N |
Product Overview
2-((4-Bromonaphthalen-1-yl)oxy)acetic acid (CAS 82746-69-8), with molecular formula C12H9BrO3 and molecular weight 279.97 g/mol. IUPAC: 2-(4-bromonaphthalen-1-yl)oxyacetic acid.
Chemical Property Profile of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid
Property Insights of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid
The XLogP value of 3.5 indicates that 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid 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 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid?
The CAS number of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid is 82746-69-8.
What is the molecular formula of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid?
The molecular formula of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid is C12H9BrO3.
What is the molecular weight of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid?
The molecular weight of 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid is 279.97 g/mol.
Where can I buy 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid?
You can request a quote for 2-((4-Bromonaphthalen-1-yl)oxy)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-((4-Bromonaphthalen-1-yl)oxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Bromonaphthalen-1-yl)oxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.