![4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid structure](/static/products/3549/354991-47-2.webp)
4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid
TL;DR: 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid (CAS 354991-47-2) is a chemical compound with molecular formula C17H18O3 and molecular weight 270.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-methyl-2-propan-2-ylphenoxy)benzoic acid
Also Known As: 4-[5-methyl-2-(propan-2-yl)phenoxy]benzoic acid, 4-[5-Methyl-2-(1-methylethyl)phenoxy]benzoic acid, 4-(5-methyl-2-propan-2-ylphenoxy)benzoic acid, 4-[5-methyl-2-(methylethyl)phenoxy]benzoic acid, AB01321701-02
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 4.60892 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.12558 |
| Heavy Atoms | 20 |
| Complexity | 612.63226 |
Chemical Identifiers
| CAS Number | 354991-47-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OC2=CC=C(C=C2)C(=O)O |
Product Overview
4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid (CAS 354991-47-2), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: 4-(5-methyl-2-propan-2-ylphenoxy)benzoic acid.
Chemical Property Profile of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid
Property Insights of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid
The XLogP value of 4.60892 indicates that 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic 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 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid?
The CAS number of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid is 354991-47-2.
What is the molecular formula of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid?
The molecular formula of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid is C17H18O3.
What is the molecular weight of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid?
The molecular weight of 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid is 270.13 g/mol.
Where can I buy 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid?
You can request a quote for 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-Methyl-2-(propan-2-yl)phenoxy]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.