| CAS Number | 1803601-76-4 |
| Catalog Number | AG01B86R |
| Chemical Name | N-[(4-fluorophenyl)methyl]-5-methylpyridin-3-amine hydrochloride |
| IUPAC Name | N-[(4-fluorophenyl)methyl]-5-methylpyridin-3-amine;hydrochloride |
| InChI | InChI=1S/C13H13FN2.ClH/c1-10-6-13(9-15-7-10)16-8-11-2-4-12(14)5-3-11;/h2-7,9,16H,8H2,1H3;1H |
| InChI Key | IMFBPOGSGGIPJL-UHFFFAOYSA-N |
| MDL Number | MFCD28246411 |
| Molecular Formula | C13H14ClFN2 |
| Molecular Weight | 252.7151 |
| SMILES | Cl.CC1=CC(NCC2=CC=C(F)C=C2)=CN=C1 |
| Synonyms | N-[(4-fluorophenyl)methyl]-5-methylpyridin-3-amine hydrochloride,
1803601-76-4,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.717g/mol |
| Monoisotopic Mass | 252.083g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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