Acetoxyphenurone
TL;DR: Acetoxyphenurone (CAS 13838-02-3) is a chemical compound with molecular formula C11H12N2O4 and molecular weight 236.07971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(carbamoylamino)-2-oxo-1-phenylethyl] acetate
Also Known As: Acetoxyphenurone, alpha-Acetoxyphenurone, alpha-Acetoxyphenylacetylurea, Mandeloylurea acetate (ester), Urea, alpha-acetoxyphenylacetyl-
Technical Specifications
| Molecular Formula | C11H12N2O4 |
| Molecular Weight | 236.07971 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 98.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.07971 Da |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
| SMILES | CC(=O)OC(C1=CC=CC=C1)C(=O)NC(=O)N |
| InChIKey | MDVVMENOOOZBJG-UHFFFAOYSA-N |
Chemical Property Profile of Acetoxyphenurone
Property Insights of Acetoxyphenurone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetoxyphenurone. The TPSA of 98.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetoxyphenurone. Following Lipinski's Rule of Five, Acetoxyphenurone 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
What is the CAS number of Acetoxyphenurone?
The CAS number of Acetoxyphenurone is 13838-02-3.
What is the molecular formula of Acetoxyphenurone?
The molecular formula of Acetoxyphenurone is C11H12N2O4.
What is the molecular weight of Acetoxyphenurone?
The molecular weight of Acetoxyphenurone is 236.07971 g/mol.
Where can I buy Acetoxyphenurone?
You can request a quote for Acetoxyphenurone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetoxyphenurone?
Yes, CoreyChem provides custom synthesis services for Acetoxyphenurone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.