3-Deoxyfructose
TL;DR: 3-Deoxyfructose (CAS 6196-57-2) is a chemical compound with molecular formula C6H12O5 and molecular weight 164.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R)-1,4,5,6-tetrahydroxyhexan-2-one
Also Known As: 3-Deoxyfructose, 3-Deoxyhexulose, 3-deoxy-D-fructose, 3-Deoxy-D-erythro-hexulose, (4S,5R)-1,4,5,6-tetrahydroxyhexan-2-one
| Molecular Formula | C6H12O5 |
|---|---|
| Molecular Weight | 164.07 g/mol |
| LogP | -2.348 |
| Topological Polar Surface Area | 97.99 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 164.06847 |
| Heavy Atoms | 11 |
| Complexity | 124.14105 |
Chemical Identifiers
| CAS Number | 6196-57-2 |
|---|---|
| SMILES | C([C@@H]([C@@H](CO)O)O)C(=O)CO |
Product Overview
3-Deoxyfructose (CAS 6196-57-2), with molecular formula C6H12O5 and molecular weight 164.07 g/mol. IUPAC: (4S,5R)-1,4,5,6-tetrahydroxyhexan-2-one.
Chemical Property Profile of 3-Deoxyfructose
Property Insights of 3-Deoxyfructose
The XLogP value of -2.348 indicates that 3-Deoxyfructose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Deoxyfructose. Following Lipinski's Rule of Five, 3-Deoxyfructose has 4 hydrogen bond donor(s) and 5 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-Deoxyfructose?
The CAS number of 3-Deoxyfructose is 6196-57-2.
What is the molecular formula of 3-Deoxyfructose?
The molecular formula of 3-Deoxyfructose is C6H12O5.
What is the molecular weight of 3-Deoxyfructose?
The molecular weight of 3-Deoxyfructose is 164.07 g/mol.
Where can I buy 3-Deoxyfructose?
You can request a quote for 3-Deoxyfructose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Deoxyfructose?
Yes, KEHONG BIO provides custom synthesis services for 3-Deoxyfructose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.