tert-Butyl uracil-1-ylacetate
TL;DR: tert-Butyl uracil-1-ylacetate (CAS 257869-92-4) is a chemical compound with molecular formula C10H14N2O4 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-(2,4-dioxopyrimidin-1-yl)acetate
Also Known As: tert-Butyl uracil-1-ylacetate, Maybridge4_000506, tert-butyl 2-(2,4-dioxopyrimidin-1-yl)acetate, IDI1_031088, BRD-K63391003-001-01-7
| Molecular Formula | C10H14N2O4 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | -0.1217 |
| Topological Polar Surface Area | 81.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.09535 |
| Heavy Atoms | 16 |
| Complexity | 492.521 |
Chemical Identifiers
| CAS Number | 257869-92-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)CN1C=CC(=O)NC1=O |
Product Overview
tert-Butyl uracil-1-ylacetate (CAS 257869-92-4), with molecular formula C10H14N2O4 and molecular weight 226.10 g/mol. IUPAC: tert-butyl 2-(2,4-dioxopyrimidin-1-yl)acetate.
Chemical Property Profile of tert-Butyl uracil-1-ylacetate
Property Insights of tert-Butyl uracil-1-ylacetate
The XLogP value of -0.1217 indicates that tert-Butyl uracil-1-ylacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.16 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl uracil-1-ylacetate. Following Lipinski's Rule of Five, tert-Butyl uracil-1-ylacetate 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
Frequently Asked Questions
What is the CAS number of tert-Butyl uracil-1-ylacetate?
The CAS number of tert-Butyl uracil-1-ylacetate is 257869-92-4.
What is the molecular formula of tert-Butyl uracil-1-ylacetate?
The molecular formula of tert-Butyl uracil-1-ylacetate is C10H14N2O4.
What is the molecular weight of tert-Butyl uracil-1-ylacetate?
The molecular weight of tert-Butyl uracil-1-ylacetate is 226.10 g/mol.
Where can I buy tert-Butyl uracil-1-ylacetate?
You can request a quote for tert-Butyl uracil-1-ylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl uracil-1-ylacetate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl uracil-1-ylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.