Ibuterol
[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate
| Molecular Formula | C20H31NO5 |
|---|---|
| Molecular Weight | 365.5 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 84.9 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 365.2202 |
| Heavy Atoms | 26 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 53034-85-8 |
|---|---|
| SMILES | CC(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C(C)C |
| InChIKey | WKHOPHIMYDJVSA-UHFFFAOYSA-N |
📖 Product Overview
Ibuterol (CAS: 53034-85-8) is a chemical compound with molecular formula C20H31NO5 and molecular weight 365.5 g/mol. Its IUPAC systematic name is [3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate.
WKHOPHIMYDJVSA-UHFFFAOYSA-N.
SMILES: CC(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C(C)C.
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