![2-[4-(Tert-butyl)phenoxy]nicotinic acid structure](/static/products/5465/54659-69-7.webp)
2-[4-(Tert-butyl)phenoxy]nicotinic acid
TL;DR: 2-[4-(Tert-butyl)phenoxy]nicotinic acid (CAS 54659-69-7) is a chemical compound with molecular formula C16H17NO3 and molecular weight 271.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-tert-butylphenoxy)pyridine-3-carboxylic acid
Also Known As: 2-[4-(tert-butyl)phenoxy]nicotinic acid, Maybridge4_000128, 2-(4-tert-butylphenoxy)pyridine-3-carboxylic acid, 2-(4-(tert-butyl)phenoxy)nicotinic acid, 2-[4- phenoxy]nicotinicacid
| Molecular Formula | C16H17NO3 |
|---|---|
| Molecular Weight | 271.12 g/mol |
| LogP | 3.8696 |
| Topological Polar Surface Area | 59.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.12085 |
| Heavy Atoms | 20 |
| Complexity | 612.36426 |
Chemical Identifiers
| CAS Number | 54659-69-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)O |
Product Overview
2-[4-(Tert-butyl)phenoxy]nicotinic acid (CAS 54659-69-7), with molecular formula C16H17NO3 and molecular weight 271.12 g/mol. IUPAC: 2-(4-tert-butylphenoxy)pyridine-3-carboxylic acid.
Chemical Property Profile of 2-[4-(Tert-butyl)phenoxy]nicotinic acid
Property Insights of 2-[4-(Tert-butyl)phenoxy]nicotinic acid
The XLogP value of 3.8696 indicates that 2-[4-(Tert-butyl)phenoxy]nicotinic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.42 Ų, 2-[4-(Tert-butyl)phenoxy]nicotinic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(Tert-butyl)phenoxy]nicotinic 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-(Tert-butyl)phenoxy]nicotinic acid?
The CAS number of 2-[4-(Tert-butyl)phenoxy]nicotinic acid is 54659-69-7.
What is the molecular formula of 2-[4-(Tert-butyl)phenoxy]nicotinic acid?
The molecular formula of 2-[4-(Tert-butyl)phenoxy]nicotinic acid is C16H17NO3.
What is the molecular weight of 2-[4-(Tert-butyl)phenoxy]nicotinic acid?
The molecular weight of 2-[4-(Tert-butyl)phenoxy]nicotinic acid is 271.12 g/mol.
Where can I buy 2-[4-(Tert-butyl)phenoxy]nicotinic acid?
You can request a quote for 2-[4-(Tert-butyl)phenoxy]nicotinic 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-(Tert-butyl)phenoxy]nicotinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(Tert-butyl)phenoxy]nicotinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.