| CAS Number | 953886-63-0 |
| Catalog Number | AG01BF9R |
| Chemical Name | [2-(2-fluorophenoxy)pyridin-4-yl]methanamine |
| IUPAC Name | [2-(2-fluorophenoxy)pyridin-4-yl]methanamine |
| InChI | InChI=1S/C12H11FN2O/c13-10-3-1-2-4-11(10)16-12-7-9(8-14)5-6-15-12/h1-7H,8,14H2 |
| InChI Key | AAEIPMVEMPNDNA-UHFFFAOYSA-N |
| MDL Number | MFCD09734469 |
| Molecular Formula | C12H11FN2O |
| Molecular Weight | 218.2269 |
| SMILES | NCC1=CC(OC2=C(F)C=CC=C2)=NC=C1 |
| Synonyms | [2-(2-fluorophenoxy)pyridin-4-yl]methanamine,
953886-63-0,
ZINC22210826,
AKOS000144878,
Z1889996357,
|
| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.231g/mol |
| Monoisotopic Mass | 218.086g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number