Isocowanol
TL;DR: Isocowanol (CAS 105742-85-6) is a chemical compound with molecular formula C29H34O7 and molecular weight 494.23044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one
Also Known As: Isocowanol, 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,6,8-trihydroxy-5-[(E)-4-hydroxy-3-methylbut-2-enyl]-2-methoxyxanthen-9-one, 1-((2E)-3,7-dimethylocta-2,6-dienyl)-3,6,8-trihydroxy-5-((E)-4-hydroxy-3-methylbut-2-enyl)-2-methoxyxanthen-9-one, 9H-Xanthen-9-one, 1-(3,7-dimethyl-2,6-octadienyl)-3,6,8-trihydroxy-5-(4-hydroxy-3-methyl-2-butenyl)-2-methoxy-
Technical Specifications
| Molecular Formula | C29H34O7 |
| Molecular Weight | 494.23044 g/mol |
| XLogP | 6.9 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.23044 Da |
| Heavy Atoms | 36 |
| Complexity | 843.0 |
| SMILES | CC(=CCC/C(=C/CC1=C(C(=CC2=C1C(=O)C3=C(C=C(C(=C3O2)C/C=C(\C)/CO)O)O)O)OC)/C)C |
| InChIKey | OCKLFXKYZPPEFU-BEQMOXJMSA-N |
Chemical Property Profile of Isocowanol
Property Insights of Isocowanol
The XLogP value of 6.9 indicates that Isocowanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isocowanol. Following Lipinski's Rule of Five, Isocowanol has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Isocowanol?
The CAS number of Isocowanol is 105742-85-6.
What is the molecular formula of Isocowanol?
The molecular formula of Isocowanol is C29H34O7.
What is the molecular weight of Isocowanol?
The molecular weight of Isocowanol is 494.23044 g/mol.
Where can I buy Isocowanol?
You can request a quote for Isocowanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isocowanol?
Yes, CoreyChem provides custom synthesis services for Isocowanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.