Isolinamarin
TL;DR: Isolinamarin (CAS 14605-42-6) is a chemical compound with molecular formula C10H17NO6 and molecular weight 247.10559 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropanenitrile
Also Known As: LINAMARIN, Isolinamarin, Phaseolunatin, alpha-Hydroxyisobutyronitrile beta-D-glucose, 2-methyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropanenitrile
Technical Specifications
| Molecular Formula | C10H17NO6 |
| Molecular Weight | 247.10559 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.10559 Da |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
| SMILES | CC(C)(C#N)OC1C(C(C(C(O1)CO)O)O)O |
| InChIKey | QLTCHMYAEJEXBT-UHFFFAOYSA-N |
Chemical Property Profile of Isolinamarin
Property Insights of Isolinamarin
The XLogP value of -1.8 indicates that Isolinamarin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isolinamarin. Following Lipinski's Rule of Five, Isolinamarin 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
What is the CAS number of Isolinamarin?
The CAS number of Isolinamarin is 14605-42-6.
What is the molecular formula of Isolinamarin?
The molecular formula of Isolinamarin is C10H17NO6.
What is the molecular weight of Isolinamarin?
The molecular weight of Isolinamarin is 247.10559 g/mol.
Where can I buy Isolinamarin?
You can request a quote for Isolinamarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isolinamarin?
Yes, CoreyChem provides custom synthesis services for Isolinamarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.