Ethyl 2-acetyl-1,3-thiazole-4-carboxylate
TL;DR: Ethyl 2-acetyl-1,3-thiazole-4-carboxylate (CAS 160060-21-9) is a chemical compound with molecular formula C8H9NO3S and molecular weight 199.03032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-acetyl-1,3-thiazole-4-carboxylate
Also Known As: Ethyl 2-acetylthiazole-4-carboxylate, Ethyl 2-acetyl-1,3-thiazole-4-carboxylate, 4-Thiazolecarboxylic acid, 2-acetyl-, ethyl ester, Ethyl2-acetylthiazole-4-carboxylate, 2-Acetyl-4-thiazolecarboxylicacidethylester
Technical Specifications
| Molecular Formula | C8H9NO3S |
| Molecular Weight | 199.03032 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.03032 Da |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
| SMILES | CCOC(=O)C1=CSC(=N1)C(=O)C |
| InChIKey | WBRRJINEWZWGLJ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate
Property Insights of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-acetyl-1,3-thiazole-4-carboxylate. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-acetyl-1,3-thiazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-acetyl-1,3-thiazole-4-carboxylate 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 Ethyl 2-acetyl-1,3-thiazole-4-carboxylate?
The CAS number of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate is 160060-21-9.
What is the molecular formula of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate?
The molecular formula of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate is C8H9NO3S.
What is the molecular weight of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate?
The molecular weight of Ethyl 2-acetyl-1,3-thiazole-4-carboxylate is 199.03032 g/mol.
Where can I buy Ethyl 2-acetyl-1,3-thiazole-4-carboxylate?
You can request a quote for Ethyl 2-acetyl-1,3-thiazole-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-acetyl-1,3-thiazole-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-acetyl-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.