RefChem:1097593
(E)-but-2-enedioic acid;1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine
Also Known As: 1-(2-(alpha-(alpha,alpha,alpha-Trifluoro-o-tolyl)benzyloxy)ethyl)pyrrolidine fumarate|Pyrrolidine, 1-(2-(alpha-(alpha,alpha,alpha-trifluoro-o-tolyl)benzyloxy)ethyl)-, fumarate|(E)-but-2-enedioic acid; 1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine|Pyrrolidine, 1-[2-[phenyl[2-(trifluoromethyl)phenyl]methoxy]ethyl]-, (E)-2-butenedioate (1:1)
| Molecular Formula | C24H26F3NO5 |
|---|---|
| Molecular Weight | 465.1763 g/mol |
| LogP | 4.619 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.1763 |
| Monoisotopic Mass | 465.1763 |
| Heavy Atoms | 33 |
| Complexity | 909.19696 |
Chemical Identifiers
| CAS Number | 2920-52-7 |
|---|---|
| SMILES | C1CCN(C1)CCOC(C2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1097593 (CAS 2920-52-7), with molecular formula C24H26F3NO5 and molecular weight 465.1763 g/mol. IUPAC: (E)-but-2-enedioic acid;1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine.
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