4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid
TL;DR: 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid (CAS 2627-73-8) is a chemical compound with molecular formula C7H13O10P and molecular weight 288.02463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6-trihydroxy-2-oxo-7-phosphonooxyheptanoic acid
Also Known As: dahp, 2-Dahp, 3-deoxy-7-o-phosphonohept-2-ulosonic acid, 3-Deoxyarabinoheptulosonate-7-phosphate, 3-deoxy-D-arabino-heptulosonate-7-phosphate
Technical Specifications
| Molecular Formula | C7H13O10P |
| Molecular Weight | 288.02463 g/mol |
| XLogP | -4.0 |
| Topological Polar Surface Area (TPSA) | 182.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 288.02463 Da |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
| SMILES | C(C(C(C(COP(=O)(O)O)O)O)O)C(=O)C(=O)O |
| InChIKey | PJWIPEXIFFQAQZ-UHFFFAOYSA-N |
Chemical Property Profile of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid
Property Insights of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid
The XLogP value of -4.0 indicates that 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 182.0 Ų indicates high polarity, suggesting 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid?
The CAS number of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid is 2627-73-8.
What is the molecular formula of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid?
The molecular formula of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid is C7H13O10P.
What is the molecular weight of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid?
The molecular weight of 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid is 288.02463 g/mol.
Where can I buy 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid?
You can request a quote for 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid?
Yes, CoreyChem provides custom synthesis services for 4,5,6-Trihydroxy-2-oxo-7-phosphonooxyheptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.