| CAS Number | 1247852-72-7 |
| Catalog Number | AG01DYKL |
| Chemical Name | [1-(2,4-difluorophenyl)propan-2-yl](methyl)amine |
| IUPAC Name | 1-(2,4-difluorophenyl)-N-methylpropan-2-amine |
| InChI | InChI=1S/C10H13F2N/c1-7(13-2)5-8-3-4-9(11)6-10(8)12/h3-4,6-7,13H,5H2,1-2H3 |
| InChI Key | CHIXUELEUNIOLJ-UHFFFAOYSA-N |
| MDL Number | MFCD16691388 |
| Molecular Formula | C10H13F2N |
| Molecular Weight | 185.2137 |
| SMILES | CNC(CC1=C(F)C=C(F)C=C1)C |
| Synonyms | [1-(2,4-difluorophenyl)propan-2-yl](methyl)amine,
AKOS011478490,
1247852-72-7,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.102g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.218g/mol |
| Monoisotopic Mass | 185.102g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number