| CAS Number | 911229-38-4 |
| Catalog Number | AG00IGHW |
| Chemical Name | n-(2-(Ethylamino)ethyl)-2,2,2-trifluoroacetamide |
| IUPAC Name | N-[2-(ethylamino)ethyl]-2,2,2-trifluoroacetamide |
| InChI | InChI=1S/C6H11F3N2O/c1-2-10-3-4-11-5(12)6(7,8)9/h10H,2-4H2,1H3,(H,11,12) |
| InChI Key | SNHHYXGDXGMSFU-UHFFFAOYSA-N |
| MDL Number | MFCD18206209 |
| Molecular Formula | C6H11F3N2O |
| Molecular Weight | 184.1595 |
| SMILES | CCNCCNC(=O)C(F)(F)F |
| Synonyms | 911229-38-4,
n-(2-(ethylamino)ethyl)-2,2,2-trifluoroacetamide,
N-[2-(ethylamino)ethyl]-2,2,2-trifluoroacetamide,
SCHEMBL467536,
Acetamide, N-[2-(ethylamino)ethyl]-2,2,2-trifluoro-,
SNHHYXGDXGMSFU-UHFFFAOYSA-N,
MFCD18206209,
ZINC62810286,
AKOS012406695,
2,2,2-trifluoro-N-(2-ethylamino-ethyl)-acetamide,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.162g/mol |
| Monoisotopic Mass | 184.082g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Certificate of Analysis
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