Isoretronecanol
[(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol
Also Known As: Isoretronecanol|(-)-isoretronecanol|9-HYDROXYHELIOTRIDANE|ISORETRONECANOL, (-)-|HELIOTRIDANE, 9-HYDROXY-|((1S,7aS)-Hexahydro-1H-pyrrolizin-1-yl)methanol|1H-Pyrrolizine-1-methanol, hexahydro-, (1S-trans)-|[(1S,7aS)-hexahydro-1H-pyrrolizin-1-yl]methanol|[(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol|(1S,7aalpha)-Hexahydro-1H-pyrrolizine-1-methanol|1H-Pyrrolizine-1-methanol,hexahydro-,(1S-trans)|1H-Pyrrolizine-1-methanol, hexahydro-, (1S,7aS)-|2,3,5,6,7,7A.ALPHA.-HEXAHYDRO-1H-PYRROLIZINE-1.BETA.-METHANOL
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.11537 g/mol |
| LogP | 0.463 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.11537 |
| Monoisotopic Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 126.426 |
Chemical Identifiers
| CAS Number | 526-63-6 |
|---|---|
| SMILES | C1C[C@H]2[C@H](CCN2C1)CO |
Product Overview
Isoretronecanol (CAS 526-63-6), with molecular formula C8H15NO and molecular weight 141.11537 g/mol. IUPAC: [(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol.
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