3-Deoxyhex-2-ulosonic acid
TL;DR: 3-Deoxyhex-2-ulosonic acid (CAS 158647-63-3) is a chemical compound with molecular formula C6H10O6 and molecular weight 178.04774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6-trihydroxy-2-oxohexanoic acid
Also Known As: 3-deoxyhex-2-ulosonic acid, 2-keto-3-deoxygluconate, 3-deoxy-2-oxo-D-gluconate, 2-Oxo-3-deoxygalactonic acid, 3-Deoxy-D-threo-hexulosonic acid
Technical Specifications
| Molecular Formula | C6H10O6 |
| Molecular Weight | 178.04774 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.04774 Da |
| Heavy Atoms | 12 |
| Complexity | 177.0 |
| SMILES | C(C(C(CO)O)O)C(=O)C(=O)O |
| InChIKey | WPAMZTWLKIDIOP-UHFFFAOYSA-N |
Chemical Property Profile of 3-Deoxyhex-2-ulosonic acid
Property Insights of 3-Deoxyhex-2-ulosonic acid
The XLogP value of -2.3 indicates that 3-Deoxyhex-2-ulosonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Deoxyhex-2-ulosonic acid. Following Lipinski's Rule of Five, 3-Deoxyhex-2-ulosonic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Deoxyhex-2-ulosonic acid?
The CAS number of 3-Deoxyhex-2-ulosonic acid is 158647-63-3.
What is the molecular formula of 3-Deoxyhex-2-ulosonic acid?
The molecular formula of 3-Deoxyhex-2-ulosonic acid is C6H10O6.
What is the molecular weight of 3-Deoxyhex-2-ulosonic acid?
The molecular weight of 3-Deoxyhex-2-ulosonic acid is 178.04774 g/mol.
Where can I buy 3-Deoxyhex-2-ulosonic acid?
You can request a quote for 3-Deoxyhex-2-ulosonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Deoxyhex-2-ulosonic acid?
Yes, CoreyChem provides custom synthesis services for 3-Deoxyhex-2-ulosonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.