3-Hexyn-5-enoic acid, 2-hydroxy-2-isopropyl-5-methyl-, 3-quinuclidinyl ester
1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate
Also Known As: RefChem:279684|ACMC-20m4m5|AC1L1P6I|AC1Q621I|CTK3J9913|OIPYMFMOSBQFCM-UHFFFAOYSA-N|J77.688B|NCI60_022806|3-Quinuclidyl isopropyl(3-methylbut-1-yn-3-enyl)glycolate A|1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate|3-HEXYN-5-ENOIC ACID, 2-HYDROXY-2-ISOPROPYL-5-METHYL-, 3-QUINUCLIDINYL ESTER|5-Hexen-3-ynoic acid,2-hydroxy-5-methyl-2-(1-methylethyl)-, 1-azabicyclo[2.2.2]oct-3-yl ester|1-Azabicyclo[2.2.2]oct-3-yl 2-hydroxy-2-isopropyl-5-methyl-5-hexen-3-ynoate|1-AZABICYCLO[2.2.2]OCT-8-YL 2-HYDROXY-5-METHYL-2-PROPAN-2-YL-HEX-5-EN- 3-YNOATE|quinuclidin-3-yl 2-hydroxy-2-isopropyl-5-methyl-hex-5-en-3-ynoate|2-Hydroxy-2-isopropyl-5-methyl-5-hexen-3-ynoic acid 3-quinuclidinyl ester|1-Azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-(propan-2-yl)hex-5-en-3-ynoate|3-HEXYN-5-ENOIC ACID,2-HYDROXY-2-ISOPROPYL-5-METHYL-,3-QUINUCLIDINYL ESTER|(1s,4s)-1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-(propan-2-yl)hex-5-en-3-ynoate|5-Hexen-3-ynoic acid, 2-hydroxy-5-methyl-2-(1-methylethyl)-, 1-azabicyclo[2.2.2]oct-3-yl ester
| Molecular Formula | C17H25NO3 |
|---|---|
| Molecular Weight | 291.18344 g/mol |
| LogP | 1.59 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.18344 |
| Heavy Atoms | 21 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 101564-61-8 |
|---|---|
| SMILES | CC(C)C(C#CC(=C)C)(C(=O)OC1CN2CCC1CC2)O |
Product Overview
3-Hexyn-5-enoic acid, 2-hydroxy-2-isopropyl-5-methyl-, 3-quinuclidinyl ester (CAS 101564-61-8), with molecular formula C17H25NO3 and molecular weight 291.18344 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-propan-2-ylhex-5-en-3-ynoate.
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