2-(2-Isopropylphenoxy)-2-methylpropanoic acid
TL;DR: 2-(2-Isopropylphenoxy)-2-methylpropanoic acid (CAS 313692-98-7) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(2-propan-2-ylphenoxy)propanoic acid
Also Known As: 2-(2-isopropylphenoxy)-2-methylpropanoic acid, 2-(2-Isopropyl-phenoxy)-2-methyl-propionic acid, 2-methyl-2-(2-propan-2-ylphenoxy)propanoic Acid, 7824AE, 2-methyl-2-[2-(propan-2-yl)phenoxy]propanoic acid
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 3.052 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 380.519 |
Chemical Identifiers
| CAS Number | 313692-98-7 |
|---|---|
| SMILES | CC(C)C1=CC=CC=C1OC(C)(C)C(=O)O |
Product Overview
2-(2-Isopropylphenoxy)-2-methylpropanoic acid (CAS 313692-98-7), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 2-methyl-2-(2-propan-2-ylphenoxy)propanoic acid.
Chemical Property Profile of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid
Property Insights of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid
The XLogP value of 3.052 indicates that 2-(2-Isopropylphenoxy)-2-methylpropanoic 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, 2-(2-Isopropylphenoxy)-2-methylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Isopropylphenoxy)-2-methylpropanoic 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-(2-Isopropylphenoxy)-2-methylpropanoic acid?
The CAS number of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid is 313692-98-7.
What is the molecular formula of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid?
The molecular formula of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid is C13H18O3.
What is the molecular weight of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid?
The molecular weight of 2-(2-Isopropylphenoxy)-2-methylpropanoic acid is 222.13 g/mol.
Where can I buy 2-(2-Isopropylphenoxy)-2-methylpropanoic acid?
You can request a quote for 2-(2-Isopropylphenoxy)-2-methylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Isopropylphenoxy)-2-methylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Isopropylphenoxy)-2-methylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.