2-Butenenitrile, 3-(((8-beta)-6-methylergolin-8-yl)methoxy)-
(Z)-3-[[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]methoxy]but-2-enenitrile
Also Known As: 6-Methyl-8-((3-methylacrylic nitrile)-3-oxymethyl)ergoline|2-Butenenitrile, 3-(((8-beta)-6-methylergolin-8-yl)methoxy)-|3-(((8-beta)-6-Methylergolin-8-yl)methoxy)-2-butenenitrile
CAS: 79675-51-7
| Molecular Formula | C20H23N3O |
|---|---|
| Molecular Weight | 321.1841 g/mol |
| LogP | 3.57188 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.1841 |
| Monoisotopic Mass | 321.1841 |
| Heavy Atoms | 24 |
| Complexity | 829.0118 |
Chemical Identifiers
| CAS Number | 79675-51-7 |
|---|---|
| SMILES | C/C(=C/C#N)/OC[C@@H]1CC2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)C |
Product Overview
2-Butenenitrile, 3-(((8-beta)-6-methylergolin-8-yl)methoxy)- (CAS 79675-51-7), with molecular formula C20H23N3O and molecular weight 321.1841 g/mol. IUPAC: (Z)-3-[[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]methoxy]but-2-enenitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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2-Butenenitrile, 3-(((8-beta)-6-methylergolin-8-yl)methoxy)- is a custom synthesis product. We offer services from milligram to kilogram scale.
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