Kethoxal
TL;DR: Kethoxal (CAS 27762-78-3) is a chemical compound with molecular formula C6H12O4 and molecular weight 148.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-1,1-dihydroxybutan-2-one
Also Known As: Kethoxal, Chetossale, KETOXAL, Ketoxalum, kethocal
| Molecular Formula | C6H12O4 |
|---|---|
| Molecular Weight | 148.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 148.07356 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 27762-78-3 |
|---|---|
| SMILES | CCOC(C)C(=O)C(O)O |
| InChIKey | YRCRRHNVYVFNTM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Kethoxal (CAS 27762-78-3), with molecular formula C6H12O4 and molecular weight 148.07 g/mol. IUPAC: 3-ethoxy-1,1-dihydroxybutan-2-one.
Chemical Property Profile of Kethoxal
Property Insights of Kethoxal
The XLogP value of -0.6 indicates that Kethoxal is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Kethoxal. Following Lipinski's Rule of Five, Kethoxal 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 Kethoxal?
The CAS number of Kethoxal is 27762-78-3.
What is the molecular formula of Kethoxal?
The molecular formula of Kethoxal is C6H12O4.
What is the molecular weight of Kethoxal?
The molecular weight of Kethoxal is 148.07 g/mol.
Where can I buy Kethoxal?
You can request a quote for Kethoxal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kethoxal?
Yes, KEHONG BIO provides custom synthesis services for Kethoxal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.