1,4-b-D-Cellotriitol
TL;DR: 1,4-b-D-Cellotriitol (CAS 61473-64-1) is a chemical compound with molecular formula C18H34O16 and molecular weight 506.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol
Also Known As: Maltotriitol, 1,4-b-D-Cellotriitol, Maltotriitol, >=95%, Syrups, hydrolyzed starch, hydrogenated, 4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol
| Molecular Formula | C18H34O16 |
|---|---|
| Molecular Weight | 506.18 g/mol |
| LogP | -7.937 |
| Topological Polar Surface Area | 279.68 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 506.1847 |
| Heavy Atoms | 34 |
| Complexity | 594.3007 |
Chemical Identifiers
| CAS Number | 61473-64-1 |
|---|---|
| SMILES | C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC(C(CO)O)C(C(CO)O)O)CO)O)O)O)O |
Product Overview
1,4-b-D-Cellotriitol (CAS 61473-64-1), with molecular formula C18H34O16 and molecular weight 506.18 g/mol. IUPAC: 4-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol.
Chemical Property Profile of 1,4-b-D-Cellotriitol
Property Insights of 1,4-b-D-Cellotriitol
The XLogP value of -7.937 indicates that 1,4-b-D-Cellotriitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 279.68 Ų indicates high polarity, suggesting 1,4-b-D-Cellotriitol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4-b-D-Cellotriitol has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-b-D-Cellotriitol?
The CAS number of 1,4-b-D-Cellotriitol is 61473-64-1.
What is the molecular formula of 1,4-b-D-Cellotriitol?
The molecular formula of 1,4-b-D-Cellotriitol is C18H34O16.
What is the molecular weight of 1,4-b-D-Cellotriitol?
The molecular weight of 1,4-b-D-Cellotriitol is 506.18 g/mol.
Where can I buy 1,4-b-D-Cellotriitol?
You can request a quote for 1,4-b-D-Cellotriitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-b-D-Cellotriitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4-b-D-Cellotriitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.