1-((2-Hydroxyethoxy)methyl)-5-nitrouracil
TL;DR: 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil (CAS 81797-05-9) is a chemical compound with molecular formula C7H9N3O6 and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyethoxymethyl)-5-nitropyrimidine-2,4-dione
Also Known As: 5-Nitroacyclouridine, 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil, 1-(2-Hydroxy-ethoxymethyl)-5-nitro-, 1-[(2-Hydroxyethoxy)methyl]-5-nitrouracil, 1-(2-hydroxyethoxymethyl)-5-nitropyrimidine-2,4-dione
| Molecular Formula | C7H9N3O6 |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.04913 |
| Heavy Atoms | 16 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 81797-05-9 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1COCCO)[N+](=O)[O-] |
| InChIKey | MNIUNDPUCLSZQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-((2-Hydroxyethoxy)methyl)-5-nitrouracil (CAS 81797-05-9), with molecular formula C7H9N3O6 and molecular weight 231.05 g/mol. IUPAC: 1-(2-hydroxyethoxymethyl)-5-nitropyrimidine-2,4-dione.
Chemical Property Profile of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil
Property Insights of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil
The XLogP value of -1.5 indicates that 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil. Following Lipinski's Rule of Five, 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil has 2 hydrogen bond donor(s) and 6 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 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil?
The CAS number of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil is 81797-05-9.
What is the molecular formula of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil?
The molecular formula of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil is C7H9N3O6.
What is the molecular weight of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil?
The molecular weight of 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil is 231.05 g/mol.
Where can I buy 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil?
You can request a quote for 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil?
Yes, KEHONG BIO provides custom synthesis services for 1-((2-Hydroxyethoxy)methyl)-5-nitrouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.