RefChem:1064251
(E)-but-2-enedioic acid;1-(tert-butylamino)-3-[2-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)ethoxy]propan-2-ol
Also Known As: 3-t-Butylamino-1-(2-(6,6-dimethylbicyclo(3.1.1)hept-2-en-2-yl)ethoxy)-2-propanol maleate|2-Propanol, 1-(2-(6,6-dimethylbicyclo(3.1.1)hept-2-en-2-yl)ethoxy)-3-((1,1-dimethylethyl)amino)-, (Z)-2-butenedioate (1:1) (salt)|Tertiobutylamino-3 ((dimethyl-6,6 bicyclo(3,1,1)hepten-2 yl)-2 ethoxy)-1 propanol-2 maleate|(E)-but-2-enedioic acid; 1-(tert-butylamino)-3-[2-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)ethoxy]propan-2-ol
| Molecular Formula | C22H37NO6 |
|---|---|
| Molecular Weight | 411.2621 g/mol |
| LogP | 2.8463 |
| Topological Polar Surface Area | 116.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 411.2621 |
| Monoisotopic Mass | 411.2621 |
| Heavy Atoms | 29 |
| Complexity | 601.2822 |
Chemical Identifiers
| CAS Number | 80768-84-9 |
|---|---|
| SMILES | CC1(C2CC=C(C1C2)CCOCC(CNC(C)(C)C)O)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1064251 (CAS 80768-84-9), with molecular formula C22H37NO6 and molecular weight 411.2621 g/mol. IUPAC: (E)-but-2-enedioic acid;1-(tert-butylamino)-3-[2-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)ethoxy]propan-2-ol.
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