Sorbitol, 1,3:2,4:5,6-tri-O-methylene
TL;DR: Sorbitol, 1,3:2,4:5,6-tri-O-methylene (CAS 52613-10-2) is a chemical compound with molecular formula C9H14O6 and molecular weight 218.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxolan-4-yl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
Also Known As: 1,3:2,4:5,6-Trimethylenesorbitol, Sorbitol, 1,3:2,4:5,6-tri-O-methylene, D-Glucitol, 1,3:2,4:5,6-tri-O-methylene, 4-(1,3-dioxolan-4-yl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine, RefChem:1098894
| Molecular Formula | C9H14O6 |
|---|---|
| Molecular Weight | 218.08 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.07904 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 52613-10-2 |
|---|---|
| SMILES | C1C(OCO1)C2C3C(COCO3)OCO2 |
| InChIKey | BEHGDGOSRVSECD-UHFFFAOYSA-N |
Product Overview
Sorbitol, 1,3:2,4:5,6-tri-O-methylene (CAS 52613-10-2), with molecular formula C9H14O6 and molecular weight 218.08 g/mol. IUPAC: 4-(1,3-dioxolan-4-yl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine.
Chemical Property Profile of Sorbitol, 1,3:2,4:5,6-tri-O-methylene
Property Insights of Sorbitol, 1,3:2,4:5,6-tri-O-methylene
The XLogP value of -0.8 indicates that Sorbitol, 1,3:2,4:5,6-tri-O-methylene is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, Sorbitol, 1,3:2,4:5,6-tri-O-methylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sorbitol, 1,3:2,4:5,6-tri-O-methylene has 0 hydrogen bond donor(s) and 6 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 Sorbitol, 1,3:2,4:5,6-tri-O-methylene?
The CAS number of Sorbitol, 1,3:2,4:5,6-tri-O-methylene is 52613-10-2.
What is the molecular formula of Sorbitol, 1,3:2,4:5,6-tri-O-methylene?
The molecular formula of Sorbitol, 1,3:2,4:5,6-tri-O-methylene is C9H14O6.
What is the molecular weight of Sorbitol, 1,3:2,4:5,6-tri-O-methylene?
The molecular weight of Sorbitol, 1,3:2,4:5,6-tri-O-methylene is 218.08 g/mol.
Where can I buy Sorbitol, 1,3:2,4:5,6-tri-O-methylene?
You can request a quote for Sorbitol, 1,3:2,4:5,6-tri-O-methylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sorbitol, 1,3:2,4:5,6-tri-O-methylene?
Yes, KEHONG BIO provides custom synthesis services for Sorbitol, 1,3:2,4:5,6-tri-O-methylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.