| CAS Number | 104994-90-3 |
| Catalog Number | AG00HAK6(AGN-PC-00NRK4) |
| Chemical Name | 2-Methoxy-5-(pyridin-2-yl)aniline |
| IUPAC Name | 2-methoxy-5-pyridin-2-ylaniline |
| InChI | InChI=1S/C12H12N2O/c1-15-12-6-5-9(8-10(12)13)11-4-2-3-7-14-11/h2-8H,13H2,1H3 |
| InChI Key | HAADUUDUGSTQQY-UHFFFAOYSA-N |
| MDL Number | MFCD18910713 |
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.2365 |
| SMILES | COC1=C(N)C=C(C2=NC=CC=C2)C=C1 |
| Synonyms | 2-Methoxy-5-(pyridin-2-yl)aniline,
104994-90-3,
Benzenamine, 2-methoxy-5-(2-pyridinyl)-,
SCHEMBL12312357,
ZINC75601580,
AKOS012990408,
AJ-121724,
AX8287191,
|
| Complexity | 198 |
| 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 | 1.8 |
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Certificate of Analysis
Lot Number