| CAS Number | 1909337-74-1 |
| Catalog Number | AG01C2DO |
| Chemical Name | 3-ETHYLAZETIDINE, TRIFLUOROACETIC ACID |
| IUPAC Name | 3-ethylazetidine;2,2,2-trifluoroacetic acid |
| InChI | InChI=1S/C5H11N.C2HF3O2/c1-2-5-3-6-4-5;3-2(4,5)1(6)7/h5-6H,2-4H2,1H3;(H,6,7) |
| InChI Key | YOYDLYQWUBZMIW-UHFFFAOYSA-N |
| MDL Number | MFCD29054952 |
| Molecular Formula | C7H12F3NO2 |
| Molecular Weight | 199.1709 |
| SMILES | OC(=O)C(F)(F)F.CCC1CNC1 |
| Synonyms | 3-ethylazetidine, trifluoroacetic acid,
1909337-74-1,
3-ethylazetidine,trifluoroacetic acid,
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| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.173g/mol |
| Monoisotopic Mass | 199.082g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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