5-dehydro-4-deoxy-D-glucarate
TL;DR: 5-dehydro-4-deoxy-D-glucarate (CAS 687-56-9) is a chemical compound with molecular formula C6H8O7 and molecular weight 192.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-2,3-dihydroxy-5-oxohexanedioic acid
Also Known As: 5-dehydro-4-deoxy-D-glucaric acid, 5-dehydro-4-deoxy-D-glucarate, 5-KDG, 3-deoxy-L-threo-hex-2-ulosaric acid, (2R,3S)-2,3-dihydroxy-5-oxohexanedioic acid
| Molecular Formula | C6H8O7 |
|---|---|
| Molecular Weight | 192.03 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.02701 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 687-56-9 |
|---|---|
| SMILES | C([C@@H]([C@H](C(=O)O)O)O)C(=O)C(=O)O |
| InChIKey | QUURPCHWPQNNGL-ZAFYKAAXSA-N |
Product Overview
5-dehydro-4-deoxy-D-glucarate (CAS 687-56-9), with molecular formula C6H8O7 and molecular weight 192.03 g/mol. IUPAC: (2R,3S)-2,3-dihydroxy-5-oxohexanedioic acid.
Chemical Property Profile of 5-dehydro-4-deoxy-D-glucarate
Property Insights of 5-dehydro-4-deoxy-D-glucarate
The XLogP value of -2.1 indicates that 5-dehydro-4-deoxy-D-glucarate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-dehydro-4-deoxy-D-glucarate. Following Lipinski's Rule of Five, 5-dehydro-4-deoxy-D-glucarate has 4 hydrogen bond donor(s) and 7 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 5-dehydro-4-deoxy-D-glucarate?
The CAS number of 5-dehydro-4-deoxy-D-glucarate is 687-56-9.
What is the molecular formula of 5-dehydro-4-deoxy-D-glucarate?
The molecular formula of 5-dehydro-4-deoxy-D-glucarate is C6H8O7.
What is the molecular weight of 5-dehydro-4-deoxy-D-glucarate?
The molecular weight of 5-dehydro-4-deoxy-D-glucarate is 192.03 g/mol.
Where can I buy 5-dehydro-4-deoxy-D-glucarate?
You can request a quote for 5-dehydro-4-deoxy-D-glucarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-dehydro-4-deoxy-D-glucarate?
Yes, KEHONG BIO provides custom synthesis services for 5-dehydro-4-deoxy-D-glucarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.