1,4:3,6-Dianhydromannitol
TL;DR: 1,4:3,6-Dianhydromannitol (CAS 641-74-7) is a chemical compound with molecular formula C6H10O4 and molecular weight 146.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol
Also Known As: isosorbide, Isomannide, D-Isoidide, Devicoran, Hydronol
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 641-74-7 |
|---|---|
| SMILES | C1C(C2C(O1)C(CO2)O)O |
| InChIKey | KLDXJTOLSGUMSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4:3,6-Dianhydromannitol (CAS 641-74-7), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol.
Chemical Property Profile of 1,4:3,6-Dianhydromannitol
Property Insights of 1,4:3,6-Dianhydromannitol
The XLogP value of -1.4 indicates that 1,4:3,6-Dianhydromannitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.9 Ų, 1,4:3,6-Dianhydromannitol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4:3,6-Dianhydromannitol has 2 hydrogen bond donor(s) and 4 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 1,4:3,6-Dianhydromannitol?
The CAS number of 1,4:3,6-Dianhydromannitol is 641-74-7.
What is the molecular formula of 1,4:3,6-Dianhydromannitol?
The molecular formula of 1,4:3,6-Dianhydromannitol is C6H10O4.
What is the molecular weight of 1,4:3,6-Dianhydromannitol?
The molecular weight of 1,4:3,6-Dianhydromannitol is 146.06 g/mol.
Where can I buy 1,4:3,6-Dianhydromannitol?
You can request a quote for 1,4:3,6-Dianhydromannitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4:3,6-Dianhydromannitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4:3,6-Dianhydromannitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.