Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate
TL;DR: Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate (CAS 109368-12-9) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12051 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate
Also Known As: BAS 00691037, ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate, 2-Ethyl-3-(4-methoxy-phenyl)-oxirane-2-carboxylic acid ethyl ester
Technical Specifications
| Molecular Formula | C14H18O4 |
| Molecular Weight | 250.12051 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 48.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.12051 Da |
| Heavy Atoms | 18 |
| Complexity | 296.0 |
| SMILES | CCC1(C(O1)C2=CC=C(C=C2)OC)C(=O)OCC |
| InChIKey | NMSHFORAZXENHQ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate
Property Insights of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate. With a topological polar surface area (TPSA) of 48.1 Ų, Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate?
The CAS number of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate is 109368-12-9.
What is the molecular formula of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate?
The molecular formula of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate is C14H18O4.
What is the molecular weight of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate?
The molecular weight of Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate is 250.12051 g/mol.
Where can I buy Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate?
You can request a quote for Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-ethyl-3-(4-methoxyphenyl)oxirane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.