2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate
TL;DR: 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate (CAS 66332-77-2) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxyphenyl) 2-[4-(2-methylpropyl)phenyl]propanoate
Also Known As: Metoxibutropate, Flubenil, Methoxybutropate, Ibuprofen guaiacol ester, Benflogin
| Molecular Formula | C20H24O3 |
|---|---|
| Molecular Weight | 312.17 g/mol |
| LogP | 4.6028 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.17255 |
| Heavy Atoms | 23 |
| Complexity | 644.1913 |
Chemical Identifiers
| CAS Number | 66332-77-2 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)C(=O)OC2=CC=CC=C2OC |
Product Overview
2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate (CAS 66332-77-2), with molecular formula C20H24O3 and molecular weight 312.17 g/mol. IUPAC: (2-methoxyphenyl) 2-[4-(2-methylpropyl)phenyl]propanoate.
Chemical Property Profile of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate
Property Insights of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate
The XLogP value of 4.6028 indicates that 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate has 0 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-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate?
The CAS number of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate is 66332-77-2.
What is the molecular formula of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate?
The molecular formula of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate is C20H24O3.
What is the molecular weight of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate?
The molecular weight of 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate is 312.17 g/mol.
Where can I buy 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate?
You can request a quote for 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxyphenyl alpha-methyl-4-(2-methylpropyl)benzeneacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.