| CAS Number | 926236-69-3 |
| Catalog Number | AG019LXO |
| Chemical Name | [1-(2,6-difluorophenyl)ethyl](methyl)amine |
| IUPAC Name | 1-(2,6-difluorophenyl)-N-methylethanamine |
| InChI | InChI=1S/C9H11F2N/c1-6(12-2)9-7(10)4-3-5-8(9)11/h3-6,12H,1-2H3 |
| InChI Key | PUOOAZHFWYJUNB-UHFFFAOYSA-N |
| MDL Number | MFCD09045114 |
| Molecular Formula | C9H11F2N |
| Molecular Weight | 171.1871 |
| SMILES | CNC(C1=C(F)C=CC=C1F)C |
| Synonyms | [1-(2,6-difluorophenyl)ethyl](methyl)amine,
926236-69-3,
AC1Q40SC,
SCHEMBL2401908,
CTK6I4578,
AKOS000128809,
AKOS022474699,
MCULE-1838258022,
NE49349,
NCGC00374125-01,
EN300-33217,
N-[1-(2,6-DIFLUOROPHENYL)ETHYL]-N-METHYLAMINE,
Z823291776,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.191g/mol |
| Monoisotopic Mass | 171.086g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number