| CAS Number | 2138112-99-7 |
| Catalog Number | AG01EK10 |
| Chemical Name | [2-(methylamino)ethyl](2.2.2-trifluoroethyl)amine dihydrochloride |
| IUPAC Name | N-methyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine;dihydrochloride |
| InChI | InChI=1S/C5H11F3N2.2ClH/c1-9-2-3-10-4-5(6,7)8;;/h9-10H,2-4H2,1H3;2*1H |
| InChI Key | NGDUIONFSKDCFP-UHFFFAOYSA-N |
| MDL Number | MFCD31559269 |
| Molecular Formula | C5H13Cl2F3N2 |
| Molecular Weight | 229.0713 |
| SMILES | Cl.Cl.CNCCNCC(F)(F)F |
| Synonyms | [2-(methylamino)ethyl](2,2,2-trifluoroethyl)amine dihydrochloride,
2138112-99-7,
|
| Complexity | 81.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.068g/mol |
| Monoisotopic Mass | 228.041g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 24.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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