Ethyl alpha-acetylbutyrate, (R)-
TL;DR: Ethyl alpha-acetylbutyrate, (R)- (CAS 130606-83-6) is a chemical compound with molecular formula C8H14O3 and molecular weight 158.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2R)-2-ethyl-3-oxobutanoate
Also Known As: Ethyl 2-acetylbutyrate, Ethyl alpha-acetylbutyrate, (R)-, ethyl (2S)-2-ethyl-3-oxobutanoate, Butanoic acid, 2-ethyl-3-oxo-, ethyl ester, (R)-
Technical Specifications
| Molecular Formula | C8H14O3 |
| Molecular Weight | 158.0943 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.0943 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| SMILES | CC[C@H](C(=O)C)C(=O)OCC |
| InChIKey | OKANYBNORCUPKZ-SSDOTTSWSA-N |
Chemical Property Profile of Ethyl alpha-acetylbutyrate, (R)-
Property Insights of Ethyl alpha-acetylbutyrate, (R)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl alpha-acetylbutyrate, (R)-. With a topological polar surface area (TPSA) of 43.4 Ų, Ethyl alpha-acetylbutyrate, (R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl alpha-acetylbutyrate, (R)- 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
What is the CAS number of Ethyl alpha-acetylbutyrate, (R)-?
The CAS number of Ethyl alpha-acetylbutyrate, (R)- is 130606-83-6.
What is the molecular formula of Ethyl alpha-acetylbutyrate, (R)-?
The molecular formula of Ethyl alpha-acetylbutyrate, (R)- is C8H14O3.
What is the molecular weight of Ethyl alpha-acetylbutyrate, (R)-?
The molecular weight of Ethyl alpha-acetylbutyrate, (R)- is 158.0943 g/mol.
Where can I buy Ethyl alpha-acetylbutyrate, (R)-?
You can request a quote for Ethyl alpha-acetylbutyrate, (R)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl alpha-acetylbutyrate, (R)-?
Yes, CoreyChem provides custom synthesis services for Ethyl alpha-acetylbutyrate, (R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.