(1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol
TL;DR: (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol (CAS 120444-24-8) is a chemical compound with molecular formula C6H11FO5 and molecular weight 182.05905 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2R,4S,5R)-6-fluorocyclohexane-1,2,3,4,5-pentol
Also Known As: 5-Deoxy-5-fluoroinositol, 1-F-scyllo-Ins, 3-F-Ins, 5-Deoxy-5-fluoro-myo-inositol, 5-Deoxy-5-fluoro-D-myo-inositol
Technical Specifications
| Molecular Formula | C6H11FO5 |
| Molecular Weight | 182.05905 g/mol |
| XLogP | -2.7 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.05905 Da |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
| SMILES | [C@H]1([C@H](C([C@H]([C@@H](C1O)O)O)F)O)O |
| InChIKey | PDTJJYSBSOKEOY-UYSNGIAKSA-N |
Chemical Property Profile of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol
Property Insights of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol
The XLogP value of -2.7 indicates that (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol. Following Lipinski's Rule of Five, (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol has 5 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 (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol?
The CAS number of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol is 120444-24-8.
What is the molecular formula of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol?
The molecular formula of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol is C6H11FO5.
What is the molecular weight of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol?
The molecular weight of (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol is 182.05905 g/mol.
Where can I buy (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol?
You can request a quote for (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol?
Yes, CoreyChem provides custom synthesis services for (1r,2s,4r,5s)-6-Fluorocyclohexane-1,2,3,4,5-pentol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.