methyl (3R,5S)-4-hydroxyadamantane-1-carboxylate
methyl (3R,5S)-4-hydroxyadamantane-1-carboxylate
Also Known As: Methyl 4-hydroxyadamantan-1-carboxylate|J1.552.985G|J1.552.989J|methyl (3S,5R)-4-hydroxyadamantane-1-carboxylate|4beta-Hydroxy-1-adamantanecarboxylic acid methyl ester|methyl (3R,4r,5S)-4-hydroxyadamantane-1-carboxylate|methyl (3R,4s,5S)-4-hydroxyadamantane-1-carboxylate|4alpha-Hydroxy-1-adamantanecarboxylic acid methyl ester
CAS: 81968-76-5
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.1256 g/mol |
| LogP | 1.3466 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.1256 |
| Monoisotopic Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 283.24237 |
Chemical Identifiers
| CAS Number | 81968-76-5 |
|---|---|
| SMILES | COC(=O)C12C[C@H]3CC(C1)C[C@@H](C2)C3O |
Product Overview
methyl (3R,5S)-4-hydroxyadamantane-1-carboxylate (CAS 81968-76-5), with molecular formula C12H18O3 and molecular weight 210.1256 g/mol. IUPAC: methyl (3R,5S)-4-hydroxyadamantane-1-carboxylate.
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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