Hydroxyurethane
TL;DR: Hydroxyurethane (CAS 589-41-3) is a chemical compound with molecular formula C3H7NO3 and molecular weight 105.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-hydroxycarbamate
Also Known As: N-Hydroxyurethane, Ethyl hydroxycarbamate, Hydroxyurethane, Ethyl N-hydroxycarbamate, N-Hydroxyurethan
| Molecular Formula | C3H7NO3 |
|---|---|
| Molecular Weight | 105.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 105.042595 |
| Heavy Atoms | 7 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 589-41-3 |
|---|---|
| SMILES | CCOC(=O)NO |
| InChIKey | VGEWEGHHYWGXGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hydroxyurethane (CAS 589-41-3), with molecular formula C3H7NO3 and molecular weight 105.04 g/mol. IUPAC: ethyl N-hydroxycarbamate.
Chemical Property Profile of Hydroxyurethane
Property Insights of Hydroxyurethane
The XLogP value of -0.2 indicates that Hydroxyurethane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.6 Ų, Hydroxyurethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroxyurethane 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 Hydroxyurethane?
The CAS number of Hydroxyurethane is 589-41-3.
What is the molecular formula of Hydroxyurethane?
The molecular formula of Hydroxyurethane is C3H7NO3.
What is the molecular weight of Hydroxyurethane?
The molecular weight of Hydroxyurethane is 105.04 g/mol.
Where can I buy Hydroxyurethane?
You can request a quote for Hydroxyurethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxyurethane?
Yes, KEHONG BIO provides custom synthesis services for Hydroxyurethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.