Ethyl 2-methyl-2-(4-methylphenyl)propanoate
TL;DR: Ethyl 2-methyl-2-(4-methylphenyl)propanoate (CAS 32454-24-3) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-2-(4-methylphenyl)propanoate
Also Known As: Ethyl 2-methyl-2-(4-methylphenyl)propanoate, 2-methyl-2-p-tolyl-propionic acid ethyl ester, ethyl 2-methyl-2-(p-tolyl)propanoate, Ethyl 2-methyl-2-(4-methylphenyl)propanoate #, alpha,alpha,4-Trimethylbenzeneacetic acid ethyl ester
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 32454-24-3 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)C1=CC=C(C=C1)C |
| InChIKey | IYUPGEAFNRIVCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-methyl-2-(4-methylphenyl)propanoate (CAS 32454-24-3), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: ethyl 2-methyl-2-(4-methylphenyl)propanoate.
Chemical Property Profile of Ethyl 2-methyl-2-(4-methylphenyl)propanoate
Property Insights of Ethyl 2-methyl-2-(4-methylphenyl)propanoate
The XLogP value of 3.4 indicates that Ethyl 2-methyl-2-(4-methylphenyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-methyl-2-(4-methylphenyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-methyl-2-(4-methylphenyl)propanoate has 0 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 Ethyl 2-methyl-2-(4-methylphenyl)propanoate?
The CAS number of Ethyl 2-methyl-2-(4-methylphenyl)propanoate is 32454-24-3.
What is the molecular formula of Ethyl 2-methyl-2-(4-methylphenyl)propanoate?
The molecular formula of Ethyl 2-methyl-2-(4-methylphenyl)propanoate is C13H18O2.
What is the molecular weight of Ethyl 2-methyl-2-(4-methylphenyl)propanoate?
The molecular weight of Ethyl 2-methyl-2-(4-methylphenyl)propanoate is 206.13 g/mol.
Where can I buy Ethyl 2-methyl-2-(4-methylphenyl)propanoate?
You can request a quote for Ethyl 2-methyl-2-(4-methylphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-2-(4-methylphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-2-(4-methylphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.