Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester
TL;DR: Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester (CAS 130611-26-6) is a chemical compound with molecular formula C9H16O5 and molecular weight 204.09978 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(2-methoxyethoxy)-3-oxobutanoate
Also Known As: ethyl 4-(2-methoxyethoxy)-3-oxobutanoate, ethyl 4-(2-methoxyethoxy)acetoacetate, 4-(2-Methoxy-ethoxy)-3-oxo-butyric acid ethyl ester, ethyl 4-(2-methoxyethoxy)-3-oxo-butanoate, Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester
Technical Specifications
| Molecular Formula | C9H16O5 |
| Molecular Weight | 204.09978 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 204.09978 Da |
| Heavy Atoms | 14 |
| Complexity | 178.0 |
| SMILES | CCOC(=O)CC(=O)COCCOC |
| InChIKey | SYFJNNYHOIAJFL-UHFFFAOYSA-N |
Chemical Property Profile of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester
Property Insights of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester. Following Lipinski's Rule of Five, Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester?
The CAS number of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester is 130611-26-6.
What is the molecular formula of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester?
The molecular formula of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester is C9H16O5.
What is the molecular weight of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester?
The molecular weight of Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester is 204.09978 g/mol.
Where can I buy Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester?
You can request a quote for Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Butanoic acid, 4-(2-methoxyethoxy)-3-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.