| CAS Number | 1178036-90-2 |
| Catalog Number | AG01BEK3(AGN-PC-0WCAUP) |
| Chemical Name | [(2-Fluoro-5-methylphenyl)methyl](methyl)amine |
| IUPAC Name | 1-(2-fluoro-5-methylphenyl)-N-methylmethanamine |
| InChI | InChI=1S/C9H12FN/c1-7-3-4-9(10)8(5-7)6-11-2/h3-5,11H,6H2,1-2H3 |
| InChI Key | KAPVWMXZZHHDSR-UHFFFAOYSA-N |
| MDL Number | MFCD12824253 |
| Molecular Formula | C9H12FN |
| Molecular Weight | 153.1967 |
| SMILES | FC1=C(C=C(C=C1)C)CNC |
| Synonyms | 1178036-90-2,
[(2-fluoro-5-methylphenyl)methyl](methyl)amine,
N-(2-Fluoro-5-methylbenzyl)-N-methylamine,
SCHEMBL14290420,
KS-00003T2Z,
ZINC38071650,
AKOS010263140,
NE41376,
TS-02045,
|
| 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