1-O-Phosphonohex-2-ulose
TL;DR: 1-O-Phosphonohex-2-ulose (CAS 49594-02-7) is a chemical compound with molecular formula C6H13O9P and molecular weight 260.02972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4,5,6-tetrahydroxy-2-oxohexyl) dihydrogen phosphate
Also Known As: L-Sorbose-1-phosphate, 1-o-phosphonohex-2-ulose, fructose-1-phosphate, Sorbose 1-phosphate, D-Fructose 1-phosphate
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H13O9P |
| Molecular Weight | 260.02972 g/mol |
| XLogP | -4.3 |
| Topological Polar Surface Area (TPSA) | 165.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 260.02972 Da |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
| SMILES | C(C(C(C(C(=O)COP(=O)(O)O)O)O)O)O |
| InChIKey | ZKLLSNQJRLJIGT-UHFFFAOYSA-N |
Product Description
Applications: 1-O-Phosphonohex-2-ulose is used in heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
1-O-Phosphonohex-2-ulose is a heterocyclic building block identified by CAS number 49594-02-7 and the molecular formula C6H13O9P and a molecular weight of 260.03 g/mol. Synonyms include L-Sorbose-1-phosphate and 1-o-phosphonohex-2-ulose.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-O-Phosphonohex-2-ulose
Property Insights of 1-O-Phosphonohex-2-ulose
The XLogP value of -4.3 indicates that 1-O-Phosphonohex-2-ulose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 165.0 Ų indicates high polarity, suggesting 1-O-Phosphonohex-2-ulose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-O-Phosphonohex-2-ulose has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-O-Phosphonohex-2-ulose?
The CAS number of 1-O-Phosphonohex-2-ulose is 49594-02-7.
What is the molecular formula of 1-O-Phosphonohex-2-ulose?
The molecular formula of 1-O-Phosphonohex-2-ulose is C6H13O9P.
What is the molecular weight of 1-O-Phosphonohex-2-ulose?
The molecular weight of 1-O-Phosphonohex-2-ulose is 260.02972 g/mol.
What are the applications of 1-O-Phosphonohex-2-ulose?
1-O-Phosphonohex-2-ulose is used in heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy 1-O-Phosphonohex-2-ulose?
You can request a quote for 1-O-Phosphonohex-2-ulose directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-O-Phosphonohex-2-ulose?
Yes, CoreyChem provides custom synthesis services for 1-O-Phosphonohex-2-ulose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.