N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid
TL;DR: N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid (CAS 129932-88-3) is a chemical compound with molecular formula C11H19F2NO8 and molecular weight 329.11295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetamido-2,3-di(18F)fluoro-4,6,7,8,9-pentahydroxynonanoic acid
Also Known As: 2,3-di(18F)Neu5Ac, N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid, 5-acetamido-2,3-bis(fluoranyl)-4,6,7,8,9-pentahydroxynonanoic acid, 5-acetamido-2,3-bis(18F)(fluoranyl)-4,6,7,8,9-pentahydroxynonanoic acid, (2xi,3xi)-5-(Acetylamino)-2,3,5-trideoxy-2,3-di(fluoro-18F)-D-glycero-D-galacto-nononic acid
Technical Specifications
| Molecular Formula | C11H19F2NO8 |
| Molecular Weight | 329.11295 g/mol |
| XLogP | -3.2 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 329.11295 Da |
| Heavy Atoms | 22 |
| Complexity | 385.0 |
| SMILES | CC(=O)NC(C(C(C(CO)O)O)O)C(C(C(C(=O)O)[18F])[18F])O |
| InChIKey | LUJZJRDYTWGVIL-DQGITARISA-N |
Chemical Property Profile of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid
Property Insights of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid
The XLogP value of -3.2 indicates that N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid has 7 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 N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid?
The CAS number of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid is 129932-88-3.
What is the molecular formula of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid?
The molecular formula of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid is C11H19F2NO8.
What is the molecular weight of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid?
The molecular weight of N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid is 329.11295 g/mol.
Where can I buy N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid?
You can request a quote for N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid?
Yes, CoreyChem provides custom synthesis services for N-Acetyl-2-deoxy-2,3-difluoroneuraminic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.