| CAS Number | 270253-15-1 |
| Catalog Number | AG01ADOQ(AGN-PC-0WO5VX) |
| Chemical Name | 3,3,3-trifluoro-2-(morpholin-4-yl)propan-1-amine |
| IUPAC Name | 3,3,3-trifluoro-2-morpholin-4-ylpropan-1-amine |
| InChI | InChI=1S/C7H13F3N2O/c8-7(9,10)6(5-11)12-1-3-13-4-2-12/h6H,1-5,11H2 |
| InChI Key | GGAVBXTWKBKIFE-UHFFFAOYSA-N |
| MDL Number | MFCD12047039 |
| Molecular Formula | C7H13F3N2O |
| Molecular Weight | 198.1861 |
| SMILES | NCC(C(F)(F)F)N1CCOCC1 |
| Synonyms | 3,3,3-trifluoro-2-(morpholin-4-yl)propan-1-amine,
270253-15-1,
AKOS009943072,
2-Morpholino-3,3,3-trifluoro-1-propanamine,
Z2442044570,
3,3,3-Trifluoro-2-morpholin-4-yl-propylamine,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.189g/mol |
| Monoisotopic Mass | 198.098g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
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