120005-55-2
| Name | CAY10621 |
| CAS | 120005-55-2 |
| Molecular Formula | C26H45NO4 |
| MDL Number | MFCD18428021 |
| Molecular Weight | 435.64 |
| MOL File | 120005-55-2.mol |
Chemical Properties
| Boiling point | 519.0±60.0 °C(Predicted) |
| density | 0.985±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | DMF: 3 mg/ml; DMSO: 2 mg/ml; Ethanol: 2.5 mg/ml |
| form | oil |
| pka | -3.98±0.60(Predicted) |
| color | colorless to light brown |
| InChI | 1S/C26H45NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(28)22-21-30-26(5,6)27(22)24(29)31-25(2,3)4/h22H,7-18,21H2,1-6H3/t22-/m0/s1 |
| InChIKey | YGBSGZPIDCXNEH-QFIPXVFZSA-N |
| SMILES | CCCCCCCCCCCCCC#CC(=O)[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C |