乙酰氧基丁酸乙酯
TL;DR: 乙酰氧基丁酸乙酯 (CAS 65202-53-1) is a chemical compound with molecular formula C8H14O4 and molecular weight 174.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酰氧基丁酸乙酯
ethyl 4-acetyloxybutanoate
Also Known As: ETHYL 4-ACETOXYBUTANOATE, Ethyl 4-Acetoxybutyrate, Ethyl 4-acetyloxybutanoate, 3-iodopyridazine, ethyl 4-(acetyloxy)butanoate
| Molecular Formula | C8H14O4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 0.8928 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 174.0892 |
| Heavy Atoms | 12 |
| Complexity | 153.13686 |
Chemical Identifiers
| CAS Number | 65202-53-1 |
|---|---|
| SMILES | CCOC(=O)CCCOC(=O)C |
Product Overview
乙酰氧基丁酸乙酯 (CAS 65202-53-1), with molecular formula C8H14O4 and molecular weight 174.09 g/mol. IUPAC: ethyl 4-acetyloxybutanoate.
Chemical Property Profile of 乙酰氧基丁酸乙酯
Property Insights of 乙酰氧基丁酸乙酯
The XLogP value of 0.8928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙酰氧基丁酸乙酯. With a topological polar surface area (TPSA) of 52.6 Ų, 乙酰氧基丁酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙酰氧基丁酸乙酯 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
Frequently Asked Questions
What is the CAS number of 乙酰氧基丁酸乙酯?
The CAS number of 乙酰氧基丁酸乙酯 is 65202-53-1.
What is the molecular formula of 乙酰氧基丁酸乙酯?
The molecular formula of 乙酰氧基丁酸乙酯 is C8H14O4.
What is the molecular weight of 乙酰氧基丁酸乙酯?
The molecular weight of 乙酰氧基丁酸乙酯 is 174.09 g/mol.
Where can I buy 乙酰氧基丁酸乙酯?
You can request a quote for 乙酰氧基丁酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酰氧基丁酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 乙酰氧基丁酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.