Iriginol hexaaceatate
TL;DR: Iriginol hexaaceatate (CAS 103652-04-6) is a chemical compound with molecular formula C27H22O14 and molecular weight 570.10095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2,3-diacetyloxy-5-(5,6,7-triacetyloxy-4-oxochromen-3-yl)phenyl] acetate
Also Known As: IRIGINOL HEXAACEATATE, Spectrum2_000400, Spectrum3_000267, Spectrum4_001559, Spectrum5_000158
Technical Specifications
| Molecular Formula | C27H22O14 |
| Molecular Weight | 570.10095 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 184.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 13 |
| Exact Mass | 570.10095 Da |
| Heavy Atoms | 41 |
| Complexity | 1100.0 |
| SMILES | CC(=O)OC1=CC(=CC(=C1OC(=O)C)OC(=O)C)C2=COC3=CC(=C(C(=C3C2=O)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | VFQVOTVAPPYKEC-UHFFFAOYSA-N |
Chemical Property Profile of Iriginol hexaaceatate
Property Insights of Iriginol hexaaceatate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iriginol hexaaceatate. The TPSA of 184.0 Ų indicates high polarity, suggesting Iriginol hexaaceatate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iriginol hexaaceatate has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Iriginol hexaaceatate?
The CAS number of Iriginol hexaaceatate is 103652-04-6.
What is the molecular formula of Iriginol hexaaceatate?
The molecular formula of Iriginol hexaaceatate is C27H22O14.
What is the molecular weight of Iriginol hexaaceatate?
The molecular weight of Iriginol hexaaceatate is 570.10095 g/mol.
Where can I buy Iriginol hexaaceatate?
You can request a quote for Iriginol hexaaceatate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Iriginol hexaaceatate?
Yes, CoreyChem provides custom synthesis services for Iriginol hexaaceatate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.