Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate
TL;DR: Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate (CAS 75844-68-7) is a chemical compound with molecular formula C8H11NO4 and molecular weight 185.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-oxo-1,3-oxazole-3-carboxylate
Also Known As: tert-butyl 2-oxo-1,3-oxazole-3-carboxylate, tert-butyl 2-oxooxazole-3(2H)-carboxylate, TERT-BUTYL 2,3-DIHYDRO-2-OXO-3-OXAZOLECARBOXYLATE, tert-butyl 2-oxo-2,3-dihydro-1,3-oxazole-3-carboxylate, tert-Butyl 2-oxo-1,3-oxazole-3(2H)-carboxylate
| Molecular Formula | C8H11NO4 |
|---|---|
| Molecular Weight | 185.07 g/mol |
| LogP | 1.2245 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.0688 |
| Heavy Atoms | 13 |
| Complexity | 354.7112 |
Chemical Identifiers
| CAS Number | 75844-68-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C=COC1=O |
Product Overview
Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate (CAS 75844-68-7), with molecular formula C8H11NO4 and molecular weight 185.07 g/mol. IUPAC: tert-butyl 2-oxo-1,3-oxazole-3-carboxylate.
Chemical Property Profile of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate
Property Insights of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate
The XLogP value of 1.2245 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate. Following Lipinski's Rule of Five, Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate 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 Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate?
The CAS number of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate is 75844-68-7.
What is the molecular formula of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate?
The molecular formula of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate is C8H11NO4.
What is the molecular weight of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate?
The molecular weight of Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate is 185.07 g/mol.
Where can I buy Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate?
You can request a quote for Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 2,3-dihydro-2-oxo-3-oxazolecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.