| CAS Number | 1314988-51-6 |
| Catalog Number | AG000WCJ(AGN-PC-0BGIIU) |
| Chemical Name | 2-Amino-5-(4-fluoro-3-methoxyphenyl)pyridine |
| IUPAC Name | 5-(4-fluoro-3-methoxyphenyl)pyridin-2-amine |
| InChI | InChI=1S/C12H11FN2O/c1-16-11-6-8(2-4-10(11)13)9-3-5-12(14)15-7-9/h2-7H,1H3,(H2,14,15) |
| InChI Key | LBMANGMZSHEEFD-UHFFFAOYSA-N |
| MDL Number | MFCD19684180 |
| Molecular Formula | C12H11FN2O |
| Molecular Weight | 218.2269 |
| SMILES | COc1cc(ccc1F)c1ccc(nc1)N |
| Synonyms | 1314988-51-6,
5-(4-Fluoro-3-methoxyphenyl)pyridin-2-amine,
2-Amino-5-(4-fluoro-3-methoxyphenyl)pyridine,
ACMC-209bn0,
CTK8B0133,
DTXSID70718569,
ANW-19354,
MFCD19684180,
ZINC77031878,
AKOS015999237,
AJ-122536,
AX8229420,
TC-108099,
ST24023757,
Z9621,
B-7109,
2-Pyridinamine, 5-(4-fluoro-3-methoxyphenyl)-,
C12H11FN2O,
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| Complexity | 227 |
| 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 | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number