3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)
TL;DR: 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) (CAS 86762-32-5) is a chemical compound with molecular formula C6H10O8S and molecular weight 242.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-1,2-dihydroxy-5,6-dioxohexan-3-yl] hydrogen sulfate
Also Known As: 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate), D-erythro-Hexos-2-ulose, 3-deoxy-, 4-(hydrogen sulfate), 3-Deoxy-4-O-sulfo-D-erythro-hexos-2-ulose, (2R,3S)-1,2-dihydroxy-5,6-dioxo-3-sulfooxy-hexane, [(2R,3S)-1,2-dihydroxy-5,6-dioxohexan-3-yl] hydrogen sulfate
| Molecular Formula | C6H10O8S |
|---|---|
| Molecular Weight | 242.01 g/mol |
| LogP | -2.8 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 242.00964 |
| Heavy Atoms | 15 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 86762-32-5 |
|---|---|
| SMILES | C([C@@H]([C@@H](CO)O)OS(=O)(=O)O)C(=O)C=O |
| InChIKey | XLRZBEABVHKWFK-RITPCOANSA-N |
Product Overview
3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) (CAS 86762-32-5), with molecular formula C6H10O8S and molecular weight 242.01 g/mol. IUPAC: [(2R,3S)-1,2-dihydroxy-5,6-dioxohexan-3-yl] hydrogen sulfate.
Chemical Property Profile of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)
Property Insights of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)
The XLogP value of -2.8 indicates that 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)?
The CAS number of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) is 86762-32-5.
What is the molecular formula of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)?
The molecular formula of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) is C6H10O8S.
What is the molecular weight of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)?
The molecular weight of 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) is 242.01 g/mol.
Where can I buy 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)?
You can request a quote for 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate)?
Yes, KEHONG BIO provides custom synthesis services for 3-Deoxy-D-erythro-hexos-2-ulose 4-(hydrogen sulfate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.