| CAS Number | 1501708-26-4 |
| Catalog Number | AG00HXRT(AGN-PC-0WG43S) |
| Chemical Name | 4-Methyl-6-phenoxypyridin-3-amine |
| IUPAC Name | 4-methyl-6-phenoxypyridin-3-amine |
| InChI | InChI=1S/C12H12N2O/c1-9-7-12(14-8-11(9)13)15-10-5-3-2-4-6-10/h2-8H,13H2,1H3 |
| InChI Key | ZZPYXYWRNLOBIX-UHFFFAOYSA-N |
| MDL Number | MFCD21815265 |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.2365 |
| SMILES | Cc1cc(Oc2ccccc2)ncc1N |
| Synonyms | 4-Methyl-6-phenoxypyridin-3-amine,
1501708-26-4,
SCHEMBL16792635,
MFCD21815265,
ZINC77296790,
AKOS017727361,
CS-0036659,
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| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.241g/mol |
| Monoisotopic Mass | 200.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
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