spirolaxine
TL;DR: spirolaxine (CAS 126382-01-2) is a chemical compound with molecular formula C23H32O6 and molecular weight 404.21988 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hydroxy-7-methoxy-3-[5-(2-methyl-1,6-dioxaspiro[4.5]decan-7-yl)pentyl]-3H-2-benzofuran-1-one
Also Known As: spirolaxine, 5-hydroxy-7-methoxy-3-(5-(2-methyl-1,6-dioxaspiro(4,5)dec-7-yl)pentyl)-2-benzofuran-1(3h)-one, 5-hydroxy-7-methoxy-3-[5-(2-methyl-1,6-dioxaspiro[4.5]decan-7-yl)pentyl]-3H-2-benzofuran-1-one, (3R)-5-hydroxy-7-methoxy-3-[5-[(2R,5R,7R)-2-methyl-1,6-dioxaspiro[4.5]decan-7-yl]pentyl]-3H-2-benzouran-1-one, 5-hydroxy-7-methoxy-3-[5-(3-methyl-4,10-dioxaspiro[4.5]decan-9-yl)pentyl]-3H-2-benzofuran-1-one
Technical Specifications
| Molecular Formula | C23H32O6 |
| Molecular Weight | 404.21988 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.21988 Da |
| Heavy Atoms | 29 |
| Complexity | 568.0 |
| SMILES | CC1CCC2(O1)CCCC(O2)CCCCCC3C4=C(C(=CC(=C4)O)OC)C(=O)O3 |
| InChIKey | CZIMFHQXGMXDMO-UHFFFAOYSA-N |
Chemical Property Profile of spirolaxine
Property Insights of spirolaxine
The XLogP value of 4.5 indicates that spirolaxine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for spirolaxine. Following Lipinski's Rule of Five, spirolaxine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of spirolaxine?
The CAS number of spirolaxine is 126382-01-2.
What is the molecular formula of spirolaxine?
The molecular formula of spirolaxine is C23H32O6.
What is the molecular weight of spirolaxine?
The molecular weight of spirolaxine is 404.21988 g/mol.
Where can I buy spirolaxine?
You can request a quote for spirolaxine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for spirolaxine?
Yes, CoreyChem provides custom synthesis services for spirolaxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.