| CAS Number | 1248688-36-9 |
| Catalog Number | AG01B92P |
| Chemical Name | 5-(6-Methoxypyridin-3-yl)-2-methylaniline |
| IUPAC Name | 5-(6-methoxypyridin-3-yl)-2-methylaniline |
| InChI | InChI=1S/C13H14N2O/c1-9-3-4-10(7-12(9)14)11-5-6-13(16-2)15-8-11/h3-8H,14H2,1-2H3 |
| InChI Key | CKMUHNNPHLKULG-UHFFFAOYSA-N |
| MDL Number | MFCD16103986 |
| Molecular Formula | C13H14N2O |
| Molecular Weight | 214.2631 |
| SMILES | COC1=NC=C(C2=CC(N)=C(C)C=C2)C=C1 |
| Synonyms | 5-(6-methoxypyridin-3-yl)-2-methylaniline,
1248688-36-9,
ZINC44272150,
AKOS011049947,
Z2009849509,
|
| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.268g/mol |
| Monoisotopic Mass | 214.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number