Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate
TL;DR: Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate (CAS 71123-14-3) is a chemical compound with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-1,3-dihydroimidazole-4-carboxylate
Also Known As: ETHYL 2-OXO-2,3-DIHYDRO-1H-IMIDAZOLE-4-CARBOXYLATE, ethyl 2-oxo-1,3-dihydroimidazole-4-carboxylate, 2-Hydroxy-5-imidazolic acid, ethyl ester, Ethyl 2-hydroxy-1H-imidazole-5-carboxylate #, RefChem:342938
| Molecular Formula | C6H8N2O3 |
|---|---|
| Molecular Weight | 156.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.0535 |
| Heavy Atoms | 11 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 71123-14-3 |
|---|---|
| SMILES | CCOC(=O)C1=CNC(=O)N1 |
| InChIKey | ZMLMEEWBSHMLBS-UHFFFAOYSA-N |
Product Overview
Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate (CAS 71123-14-3), with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol. IUPAC: ethyl 2-oxo-1,3-dihydroimidazole-4-carboxylate.
Chemical Property Profile of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate
Property Insights of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate
The XLogP value of -0.4 indicates that Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate has 2 hydrogen bond donor(s) and 3 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 Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate?
The CAS number of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate is 71123-14-3.
What is the molecular formula of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate?
The molecular formula of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate is C6H8N2O3.
What is the molecular weight of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate?
The molecular weight of Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate is 156.05 g/mol.
Where can I buy Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate?
You can request a quote for Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-oxo-2,3-dihydro-1H-imidazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.