| CAS Number | 1182782-12-2 |
| Catalog Number | AG01AJ4L(AGN-PC-0WOC9R) |
| Chemical Name | 2-[Methyl(2,2,2-trifluoroethyl)amino]ethan-1-ol |
| IUPAC Name | 2-[methyl(2,2,2-trifluoroethyl)amino]ethanol |
| InChI | InChI=1S/C5H10F3NO/c1-9(2-3-10)4-5(6,7)8/h10H,2-4H2,1H3 |
| InChI Key | YMHYJSJSUSFLMX-UHFFFAOYSA-N |
| MDL Number | MFCD12799740 |
| Molecular Formula | C5H10F3NO |
| Molecular Weight | 157.1342 |
| SMILES | OCCN(C)CC(F)(F)F |
| Synonyms | 2-[methyl(2,2,2-trifluoroethyl)amino]ethan-1-ol,
1182782-12-2,
ZINC37665257,
AKOS010114235,
MCULE-2229912846,
NE46363,
EN300-79756,
Z648348478,
|
| Complexity | 93.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.136g/mol |
| Monoisotopic Mass | 157.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number