| CAS Number | 954269-88-6 |
| Catalog Number | AG01BXKI |
| Chemical Name | {2-amino-2-[3-(trifluoromethyl)phenyl]ethyl}dimethylamine |
| IUPAC Name | N',N'-dimethyl-1-[3-(trifluoromethyl)phenyl]ethane-1,2-diamine |
| InChI | InChI=1S/C11H15F3N2/c1-16(2)7-10(15)8-4-3-5-9(6-8)11(12,13)14/h3-6,10H,7,15H2,1-2H3 |
| InChI Key | FXOGIUBNPMYFMF-UHFFFAOYSA-N |
| MDL Number | MFCD09736413 |
| Molecular Formula | C11H15F3N2 |
| Molecular Weight | 232.2454 |
| SMILES | CN(CC(C1=CC(C(F)(F)F)=CC=C1)N)C |
| Synonyms | {2-amino-2-[3-(trifluoromethyl)phenyl]ethyl}dimethylamine,
954269-88-6,
CTK6I0187,
AKOS009138620,
N-{2-AMINO-2-[3-(TRIFLUOROMETHYL)PHENYL]ETHYL}-N,N-DIMETHYLAMINE,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.119g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.25g/mol |
| Monoisotopic Mass | 232.119g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number