(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazaniumoctane-1-sulfonate
(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;octane-1-sulfonate
| Molecular Formula | C29H53NO4S |
|---|---|
| Molecular Weight | 511.8 g/mol |
| Topological Polar Surface Area | 85.8 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 511.36954 |
| Heavy Atoms | 35 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 67603-59-2 |
|---|---|
| SMILES | CCCCCCCCS(=O)(=O)[O-].CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O |
| InChIKey | YEWWROBYEIERTF-UHFFFAOYSA-M |
📖 Product Overview
(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazaniumoctane-1-sulfonate (CAS: 67603-59-2) is a chemical compound with molecular formula C29H53NO4S and molecular weight 511.8 g/mol. Its IUPAC systematic name is (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;octane-1-sulfonate.
YEWWROBYEIERTF-UHFFFAOYSA-M.
SMILES: CCCCCCCCS(=O)(=O)[O-].CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O.
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