| CAS Number | 1909327-16-7 |
| Catalog Number | AG01C6H4 |
| Chemical Name | 2-(azetidin-3-yloxy)acetic acid; trifluoroacetic acid |
| IUPAC Name | 2-(azetidin-3-yloxy)acetic acid;2,2,2-trifluoroacetic acid |
| InChI | InChI=1S/C5H9NO3.C2HF3O2/c7-5(8)3-9-4-1-6-2-4;3-2(4,5)1(6)7/h4,6H,1-3H2,(H,7,8);(H,6,7) |
| InChI Key | PFSNILWXVUUAJA-UHFFFAOYSA-N |
| MDL Number | MFCD29907119 |
| Molecular Formula | C7H10F3NO5 |
| Molecular Weight | 245.1532 |
| SMILES | OC(COC1CNC1)=O.OC(C(F)(F)F)=O |
| Synonyms | 2-(azetidin-3-yloxy)acetic acid; trifluoroacetic acid,
1909327-16-7,
2-(azetidin-3-yloxy)acetic acid, trifluoroacetic acid,
Z2467523280,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.154g/mol |
| Monoisotopic Mass | 245.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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