C62H132O45P6-6 — CID 158978362
2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate (PubChem CID 158978362) has the molecular formula C62H132O45P6-6 and a molecular weight of 1783.54 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate.
| Compound Name | 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate |
|---|---|
| PubChem CID | 158978362 |
| Molecular Formula | C62H132O45P6-6 |
| Molecular Weight | 1783.54 g/mol |
| Exact Mass | 1782.65 |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate;2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy-oxidophosphoryl]oxyethoxy]ethoxy]ethoxy-methylphosphinate |
| SMILES | COCCOCCOCCOCCOCCOCCOCCOCCOP(C)(=O)[O-].COCCOCCOCCOCCOCCOCCOP(C)(=O)[O-].COCCOCCOCCOCCOP(=O)([O-])OCCOCCOCCOP(C)(=O)[O-].COCCOCCOCCOP(=O)([O-])OCCOCCOCCOP(C)(=O)[O-] |
| InChI | InChI=1S/C18H39O11P.C16H36O13P2.C14H32O12P2.C14H31O9P/c1-21-3-4-22-5-6-23-7-8-24-9-10-25-11-12-26-13-14-27-15-16-28-17-18-29-30(2,19)20;1-21-3-4-22-5-6-23-7-8-25-12-15-28-31(19,20)29-16-13-26-10-9-24-11-14-27-30(2,17)18;1-19-3-4-20-5-6-22-10-13-25-28(17,18)26-14-11-23-8-7-21-9-12-24-27(2,15)16;1-17-3-4-18-5-6-19-7-8-20-9-10-21-11-12-22-13-14-23-24(2,15)16/h3-18H2,1-2H3,(H,19,20);3-16H2,1-2H3,(H,17,18)(H,19,20);3-14H2,1-2H3,(H,15,16)(H,17,18);3-14H2,1-2H3,(H,15,16)/p-6 |
| InChIKey | JORGJASVTYWZEH-UHFFFAOYSA-H |
| XLogP | -1.32 |
| TPSA | 545.37 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 45 |
| Rotatable Bonds | 89 |
| Heavy Atoms | 113 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1783.54 |
| LogP ≤ 5 | -1.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 45 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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