C82H108N4O6Os4 — CID 157456131
4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) (PubChem CID 157456131) has the molecular formula C82H108N4O6Os4 and a molecular weight of 2006.71 g/mol. Its IUPAC name is 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)).
| Compound Name | 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) |
|---|---|
| PubChem CID | 157456131 |
| Molecular Formula | C82H108N4O6Os4 |
| Molecular Weight | 2006.71 g/mol |
| Exact Mass | 2012.67 |
| IUPAC Name | 4-methoxy-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;4-methoxy-2-(2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(3-methyl-2-octoxybenzene-6-id-1-yl)pyridine;3-methyl-2-(2-octoxybenzene-6-id-1-yl)pyridine;tetrakis(osmium(1+)) |
| SMILES | CCCCCCCCOc1c(-c2cc(OC)ccn2)[c-]ccc1C.CCCCCCCCOc1c(-c2ncccc2C)[c-]ccc1C.CCCCCCCCOc1ccc[c-]c1-c1cc(OC)ccn1.CCCCCCCCOc1ccc[c-]c1-c1ncccc1C.[Os+].[Os+].[Os+].[Os+] |
| InChI | InChI=1S/C21H28NO2.C21H28NO.C20H26NO2.C20H26NO.4Os/c1-4-5-6-7-8-9-15-24-21-17(2)11-10-12-19(21)20-16-18(23-3)13-14-22-20;1-4-5-6-7-8-9-16-23-21-18(3)12-10-14-19(21)20-17(2)13-11-15-22-20;1-3-4-5-6-7-10-15-23-20-12-9-8-11-18(20)19-16-17(22-2)13-14-21-19;1-3-4-5-6-7-10-16-22-19-14-9-8-13-18(19)20-17(2)12-11-15-21-20;;;;/h10-11,13-14,16H,4-9,15H2,1-3H3;10-13,15H,4-9,16H2,1-3H3;8-9,12-14,16H,3-7,10,15H2,1-2H3;8-9,11-12,14-15H,3-7,10,16H2,1-2H3;;;;/q4*-1;4*+1 |
| InChIKey | HHSYKLDCNKSYDK-UHFFFAOYSA-N |
| XLogP | 22.39 |
| TPSA | 106.94 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 38 |
| Heavy Atoms | 96 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2006.71 |
| LogP ≤ 5 | 22.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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