N-trifluoroacetylproline anhydride
[(2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carbonyl] (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate
Also Known As: N-TA-Pro-A|N-Trifluoroacetylproline anhydride|KST-1A0282|L-Proline, 1-(trifluoroacetyl)-, anhydride|(S,S)-N-Trifluoroacetylproline anhydride|(2s)-1-(trifluoroacetyl)pyrrolidine-2-carboxylic anhydride(non-preferred name)|[(2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carbonyl] (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate
| Molecular Formula | C14H14F6N2O5 |
|---|---|
| Molecular Weight | 404.0807 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 84.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.0807 |
| Monoisotopic Mass | 404.0807 |
| Heavy Atoms | 27 |
| Complexity | 593.0 |
Chemical Identifiers
| CAS Number | 6963-11-7 |
|---|---|
| SMILES | C1C[C@H](N(C1)C(=O)C(F)(F)F)C(=O)OC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F |
| InChIKey | XTEMTLUJKNBNNQ-YUMQZZPRSA-N |
Product Overview
N-trifluoroacetylproline anhydride (CAS 6963-11-7), with molecular formula C14H14F6N2O5 and molecular weight 404.0807 g/mol. IUPAC: [(2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carbonyl] (2S)-1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carboxylate.
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