Etopophos
TL;DR: Etopophos (CAS 117091-64-2) is a chemical compound with molecular formula C29H33O16P and molecular weight 668.15063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[(5S,5aR,8aR,9R)-5-[(7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] dihydrogen phosphate
Also Known As: Etopophos, Etopofos, Etophos, ETOPOSIDE PHOSPHATE, Etoposide Phosphonate
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H33O16P |
| Molecular Weight | 668.15063 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 207.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 668.15063 Da |
| Heavy Atoms | 46 |
| Complexity | 1140.0 |
| SMILES | CC1OCC2C(O1)C(C(C(O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OP(=O)(O)O)OC)O)O |
| InChIKey | LIQODXNTTZAGID-GDAYZDJCSA-N |
Chemical Property Profile of Etopophos
Property Insights of Etopophos
The XLogP value of -0.7 indicates that Etopophos is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 207.0 Ų indicates high polarity, suggesting Etopophos may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Etopophos has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Etopophos?
The CAS number of Etopophos is 117091-64-2.
What is the molecular formula of Etopophos?
The molecular formula of Etopophos is C29H33O16P.
What is the molecular weight of Etopophos?
The molecular weight of Etopophos is 668.15063 g/mol.
Where can I buy Etopophos?
You can request a quote for Etopophos directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Etopophos?
Yes, CoreyChem provides custom synthesis services for Etopophos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.