| CAS Number | 1249121-13-8 |
| Catalog Number | AG01BDT7(AGN-PC-0WCAUE) |
| Chemical Name | [(4-fluoro-2-methylphenyl)methyl](methyl)amine |
| IUPAC Name | 1-(4-fluoro-2-methylphenyl)-N-methylmethanamine |
| InChI | InChI=1S/C9H12FN/c1-7-5-9(10)4-3-8(7)6-11-2/h3-5,11H,6H2,1-2H3 |
| InChI Key | HSOBTJJNTLBNEW-UHFFFAOYSA-N |
| MDL Number | MFCD16622233 |
| Molecular Formula | C9H12FN |
| Molecular Weight | 153.1967 |
| SMILES | CNCC1=C(C)C=C(F)C=C1 |
| Synonyms | 1249121-13-8,
N-(4-Fluoro-2-methylbenzyl)-N-methylamine,
[(4-fluoro-2-methylphenyl)methyl](methyl)amine,
SCHEMBL14613818,
KS-00003T2W,
ZINC50568988,
AKOS011405338,
NE42025,
TS-02042,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.2g/mol |
| Monoisotopic Mass | 153.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number