difructose anhydride III
TL;DR: difructose anhydride III (CAS 81129-73-9) is a chemical compound with molecular formula C12H20O10 and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3'S,4'S,4aR,5'R,6R,7R,7aS)-4a,5',6-tris(hydroxymethyl)spiro[3,6,7,7a-tetrahydrofuro[2,3-b][1,4]dioxine-2,2'-oxolane]-3',4',7-triol
Also Known As: Difructose anhydride III, Dfa III, Difructose III, Difructose anhydride, DIFRUCTOSEANHYDRIDEIII
| Molecular Formula | C12H20O10 |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | -3.7 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.10565 |
| Heavy Atoms | 22 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 81129-73-9 |
|---|---|
| SMILES | C1[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)O[C@H]3[C@@H]([C@H](O[C@]3(O1)CO)CO)O |
| InChIKey | KSRQDWNGXKYIDO-TWOHWVPZSA-N |
Product Overview
difructose anhydride III (CAS 81129-73-9), with molecular formula C12H20O10 and molecular weight 324.11 g/mol. IUPAC: (2R,3'S,4'S,4aR,5'R,6R,7R,7aS)-4a,5',6-tris(hydroxymethyl)spiro[3,6,7,7a-tetrahydrofuro[2,3-b][1,4]dioxine-2,2'-oxolane]-3',4',7-triol.
Chemical Property Profile of difructose anhydride III
Property Insights of difructose anhydride III
The XLogP value of -3.7 indicates that difructose anhydride III is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.0 Ų indicates high polarity, suggesting difructose anhydride III may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, difructose anhydride III has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of difructose anhydride III?
The CAS number of difructose anhydride III is 81129-73-9.
What is the molecular formula of difructose anhydride III?
The molecular formula of difructose anhydride III is C12H20O10.
What is the molecular weight of difructose anhydride III?
The molecular weight of difructose anhydride III is 324.11 g/mol.
Where can I buy difructose anhydride III?
You can request a quote for difructose anhydride III directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for difructose anhydride III?
Yes, KEHONG BIO provides custom synthesis services for difructose anhydride III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.