2,6-Anhydro-3-deoxyoctonate
TL;DR: 2,6-Anhydro-3-deoxyoctonate (CAS 107573-28-4) is a chemical compound with molecular formula C8H14O8 and molecular weight 238.06886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3S,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetic acid
Also Known As: 2-Deoxy-beta-kdo, 2,6-Anhydro-3-deoxyoctonate, 2,6-Anhydro-3-deoxy-D-glycero-D-talooctonate, 2-Deoxymanno-2-octulopyranosonic acid, 2-Deoxyoct-3-ulopyranosonic acid
Technical Specifications
| Molecular Formula | C8H14O8 |
| Molecular Weight | 238.06886 g/mol |
| XLogP | -2.7 |
| Topological Polar Surface Area (TPSA) | 148.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.06886 Da |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
| SMILES | C([C@@H]1[C@H]([C@@H]([C@@H](C(O1)(CC(=O)O)O)O)O)O)O |
| InChIKey | KPSXOPOQCZNCGI-PDMHJPEASA-N |
Chemical Property Profile of 2,6-Anhydro-3-deoxyoctonate
Property Insights of 2,6-Anhydro-3-deoxyoctonate
The XLogP value of -2.7 indicates that 2,6-Anhydro-3-deoxyoctonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting 2,6-Anhydro-3-deoxyoctonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,6-Anhydro-3-deoxyoctonate has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,6-Anhydro-3-deoxyoctonate?
The CAS number of 2,6-Anhydro-3-deoxyoctonate is 107573-28-4.
What is the molecular formula of 2,6-Anhydro-3-deoxyoctonate?
The molecular formula of 2,6-Anhydro-3-deoxyoctonate is C8H14O8.
What is the molecular weight of 2,6-Anhydro-3-deoxyoctonate?
The molecular weight of 2,6-Anhydro-3-deoxyoctonate is 238.06886 g/mol.
Where can I buy 2,6-Anhydro-3-deoxyoctonate?
You can request a quote for 2,6-Anhydro-3-deoxyoctonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Anhydro-3-deoxyoctonate?
Yes, CoreyChem provides custom synthesis services for 2,6-Anhydro-3-deoxyoctonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.