Ethyl (3R)-4-cyano-3-hydroxybutanoate
TL;DR: Ethyl (3R)-4-cyano-3-hydroxybutanoate (CAS 141942-85-0) is a chemical compound with molecular formula C7H11NO3 and molecular weight 157.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (3R)-4-cyano-3-hydroxybutanoate
Also Known As: Ethyl (R)-(-)-4-cyano-3-hydroxybutyate, ethyl (3R)-4-cyano-3-hydroxybutanoate, Ethyl (R)-(-)-4-cyano-3-hydroxybutyrate, Atorvastatin Impurity 54, (r)-ethyl 4-cyano-3-hydroxybutanoate
Technical Specifications
| Molecular Formula | C7H11NO3 |
| Molecular Weight | 157.0739 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 70.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 157.0739 Da |
| Heavy Atoms | 11 |
| Complexity | 170.0 |
| SMILES | CCOC(=O)C[C@@H](CC#N)O |
| InChIKey | LOQFROBMBSKWQY-ZCFIWIBFSA-N |
Chemical Property Profile of Ethyl (3R)-4-cyano-3-hydroxybutanoate
Property Insights of Ethyl (3R)-4-cyano-3-hydroxybutanoate
The XLogP value of -0.5 indicates that Ethyl (3R)-4-cyano-3-hydroxybutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl (3R)-4-cyano-3-hydroxybutanoate. Following Lipinski's Rule of Five, Ethyl (3R)-4-cyano-3-hydroxybutanoate has 1 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 (3R)-4-cyano-3-hydroxybutanoate?
The CAS number of Ethyl (3R)-4-cyano-3-hydroxybutanoate is 141942-85-0.
What is the molecular formula of Ethyl (3R)-4-cyano-3-hydroxybutanoate?
The molecular formula of Ethyl (3R)-4-cyano-3-hydroxybutanoate is C7H11NO3.
What is the molecular weight of Ethyl (3R)-4-cyano-3-hydroxybutanoate?
The molecular weight of Ethyl (3R)-4-cyano-3-hydroxybutanoate is 157.0739 g/mol.
Where can I buy Ethyl (3R)-4-cyano-3-hydroxybutanoate?
You can request a quote for Ethyl (3R)-4-cyano-3-hydroxybutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl (3R)-4-cyano-3-hydroxybutanoate?
Yes, CoreyChem provides custom synthesis services for Ethyl (3R)-4-cyano-3-hydroxybutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.