Mandelic acid, alpha-(3-methyl-1-pentynyl)-, 1-methyl-4-piperidyl ester
(1-methylpiperidin-4-yl) 2-hydroxy-5-methyl-2-phenylhept-3-ynoate
Also Known As: ACMC-20m4ql|RefChem:1088805|AC1L1PU7|1H-Inden-1-one, 5-bromo-|AC1Q61U1|CTK4A0139|HDUXUOVCPBZSCM-UHFFFAOYSA-N|1-Methyl-4-piperidyl phenyl(3-methyl-1-pentynyl)glycolate|J147.723D|(1-methylpiperidin-4-yl) 2-hydroxy-5-methyl-2-phenylhept-3-ynoate|1-methylpiperidin-4-yl 2-hydroxy-5-methyl-2-phenylhept-3-ynoate|MANDELIC ACID, alpha-(3-METHYL-1-PENTYNYL)-, 1-METHYL-4-PIPERIDYL ESTER|Benzeneacetic acid, a-hydroxy-a-(3-methyl-1-pentyn-1-yl)-,1-methyl-4-piperidinyl ester|alpha-(3-Methyl-1-pentynyl)-alpha-hydroxybenzeneacetic acid 1-methyl-4-piperidinyl ester|Benzeneacetic acid, alpha-hydroxy-alpha-(3-methyl-1-pentyn-1-yl)-, 1-methyl-4-piperidinyl ester|Benzeneacetic acid,a-hydroxy-a-(3-methyl-3-buten-1-yn-1-yl)-,2-methyl-1-azabicyclo[2.2.2]oct-3-yl ester
| Molecular Formula | C20H27NO3 |
|---|---|
| Molecular Weight | 329.1991 g/mol |
| LogP | 2.56 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.1991 |
| Heavy Atoms | 24 |
| Complexity | 596.3 |
Chemical Identifiers
| CAS Number | 101711-09-5 |
|---|---|
| SMILES | CCC(C)C#CC(C1=CC=CC=C1)(C(=O)OC2CCN(CC2)C)O |
Product Overview
Mandelic acid, alpha-(3-methyl-1-pentynyl)-, 1-methyl-4-piperidyl ester (CAS 101711-09-5), with molecular formula C20H27NO3 and molecular weight 329.1991 g/mol. IUPAC: (1-methylpiperidin-4-yl) 2-hydroxy-5-methyl-2-phenylhept-3-ynoate.
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