![4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid structure](/static/products/149/149288-36-8.png)
4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid
TL;DR: 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid (CAS 149288-36-8) 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-[(2,3,6-trimethylphenoxy)methyl]benzoic acid
Also Known As: 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid, Benzoic acid, 4-[(2,3,6-trimethylphenoxy)methyl]-
| Molecular Formula | C17H18O3 |
|---|---|
| Molecular Weight | 270.13 g/mol |
| LogP | 3.88906 |
| 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 | 627.4285 |
Chemical Identifiers
| CAS Number | 149288-36-8 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C)OCC2=CC=C(C=C2)C(=O)O)C |
Product Overview
4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid (CAS 149288-36-8), with molecular formula C17H18O3 and molecular weight 270.13 g/mol. IUPAC: 4-[(2,3,6-trimethylphenoxy)methyl]benzoic acid.
Chemical Property Profile of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid
Property Insights of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid
The XLogP value of 3.88906 indicates that 4-[(2,3,6-trimethylphenoxy)methyl]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-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,3,6-trimethylphenoxy)methyl]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-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid?
The CAS number of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid is 149288-36-8.
What is the molecular formula of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid?
The molecular formula of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid is C17H18O3.
What is the molecular weight of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid?
The molecular weight of 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid is 270.13 g/mol.
Where can I buy 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid?
You can request a quote for 4-[(2,3,6-trimethylphenoxy)methyl]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-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,3,6-trimethylphenoxy)methyl]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.