(2,4-dioxo-1H-pyrimidin-5-yl) acetate
TL;DR: (2,4-dioxo-1H-pyrimidin-5-yl) acetate (CAS 372118-00-8) is a chemical compound with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dioxo-1H-pyrimidin-5-yl) acetate
Also Known As: 5-ACETOXYURACIL, (2,4-dioxo-1H-pyrimidin-5-yl) acetate, 2,4-Dioxo-1,2,3,4-tetrahydropyrimidin-5-yl acetate, 5-acetoxy-1H-pyrimidine-2,4-dione, 6-Methoxy-3-nitropyridin-2-ol
| Molecular Formula | C6H6N2O4 |
|---|---|
| Molecular Weight | 170.03 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.03276 |
| Heavy Atoms | 12 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 372118-00-8 |
|---|---|
| SMILES | CC(=O)OC1=CNC(=O)NC1=O |
| InChIKey | DSIXOYBJKMTFMC-UHFFFAOYSA-N |
Product Overview
(2,4-dioxo-1H-pyrimidin-5-yl) acetate (CAS 372118-00-8), with molecular formula C6H6N2O4 and molecular weight 170.03 g/mol. IUPAC: (2,4-dioxo-1H-pyrimidin-5-yl) acetate.
Chemical Property Profile of (2,4-dioxo-1H-pyrimidin-5-yl) acetate
Property Insights of (2,4-dioxo-1H-pyrimidin-5-yl) acetate
The XLogP value of -1.0 indicates that (2,4-dioxo-1H-pyrimidin-5-yl) acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,4-dioxo-1H-pyrimidin-5-yl) acetate. Following Lipinski's Rule of Five, (2,4-dioxo-1H-pyrimidin-5-yl) acetate has 2 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 (2,4-dioxo-1H-pyrimidin-5-yl) acetate?
The CAS number of (2,4-dioxo-1H-pyrimidin-5-yl) acetate is 372118-00-8.
What is the molecular formula of (2,4-dioxo-1H-pyrimidin-5-yl) acetate?
The molecular formula of (2,4-dioxo-1H-pyrimidin-5-yl) acetate is C6H6N2O4.
What is the molecular weight of (2,4-dioxo-1H-pyrimidin-5-yl) acetate?
The molecular weight of (2,4-dioxo-1H-pyrimidin-5-yl) acetate is 170.03 g/mol.
Where can I buy (2,4-dioxo-1H-pyrimidin-5-yl) acetate?
You can request a quote for (2,4-dioxo-1H-pyrimidin-5-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4-dioxo-1H-pyrimidin-5-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (2,4-dioxo-1H-pyrimidin-5-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.