| CAS Number | 1803610-57-2 |
| Catalog Number | AG01BH81 |
| Chemical Name | 1-(2,2,2-trifluoroacetyl)azetidin-3-one |
| IUPAC Name | 1-(2,2,2-trifluoroacetyl)azetidin-3-one |
| InChI | InChI=1S/C5H4F3NO2/c6-5(7,8)4(11)9-1-3(10)2-9/h1-2H2 |
| InChI Key | NWGKTFLTBNWJIJ-UHFFFAOYSA-N |
| MDL Number | MFCD28246252 |
| Molecular Formula | C5H4F3NO2 |
| Molecular Weight | 167.0860 |
| SMILES | FC(C(=O)N1CC(C1)=O)(F)F |
| Synonyms | 1-(2,2,2-trifluoroacetyl)azetidin-3-one,
1803610-57-2,
1-(trifluoroacetyl)azetidin-3-one,
AKOS030632138,
ZINC170618889,
CS-0090868,
Z1983079535,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.087g/mol |
| Monoisotopic Mass | 167.019g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number