Exepanol
(3S,5R)-3-(methylamino)-2,3,4,5-tetrahydro-1-benzoxepin-5-ol
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.24 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 41.5 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 77416-65-0 |
|---|---|
| SMILES | CNC1CC(C2=CC=CC=C2OC1)O |
| InChIKey | JWUPWOYNGNTOKD-WCBMZHEXSA-N |
📖 Product Overview
Exepanol (CAS: 77416-65-0) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.24 g/mol. Its IUPAC systematic name is (3S,5R)-3-(methylamino)-2,3,4,5-tetrahydro-1-benzoxepin-5-ol.
JWUPWOYNGNTOKD-WCBMZHEXSA-N.
SMILES: CNC1CC(C2=CC=CC=C2OC1)O.
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