RefChem:347373
(2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate
Also Known As: RefChem:347373|AC1Q60LY|AC1L1P69|J77.659I|2-Methyl-3-quinuclidyl isopropyl(3-methyl-but-1-yn-3-enyl)glycolate|Hexa-3-yn-5-enoic acid, 2-hydroxy-2-isopropyl-5-methyl-, 2-methyl-3-quinuclidinyl ester|(7-Methyl-1-azabicyclo[2.2.2]octan-8-yl)2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate|2-Methyl-3-quinuclidylisopropyl(3-methyl-but-1-yn-3-enyl)glycolate|2-Hydroxy-2-isopropyl-5-methyl-5-hexen-3-ynoic acid 2-methyl-3-quinuclidinyl ester|2-methyl-1-azabicyclo[2.2.2]oct-3-yl 2-hydroxy-5-methyl-2-(propan-2-yl)hex-5-en-3-ynoate|HEXA-3-YN-5-ENOIC ACID, 2-HYDROXY-2-ISOPROPYL-5-METHYL-, 2-METHYL-3-QUINUCLIDINY|(1r,4r)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-(propan-2-yl)hex-5-en-3-ynoate|(2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate|2-Methyl-1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-(propan-2-yl)hex-5-en-3-ynoate
| Molecular Formula | C18H27NO3 |
|---|---|
| Molecular Weight | 305.1991 g/mol |
| LogP | 1.98 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.1991 |
| Heavy Atoms | 22 |
| Complexity | 506.2 |
Chemical Identifiers
| CAS Number | 101564-58-3 |
|---|---|
| SMILES | CC1C(C2CCN1CC2)OC(=O)C(C#CC(=C)C)(C(C)C)O |
Product Overview
RefChem:347373 (CAS 101564-58-3), with molecular formula C18H27NO3 and molecular weight 305.1991 g/mol. IUPAC: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate.
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