| CAS Number | 871020-35-8 |
| Catalog Number | AG019EST(AGN-PC-0IFO27) |
| Chemical Name | 4-[(6-methoxypyridin-3-yl)oxy]-3-methylaniline |
| IUPAC Name | 4-(6-methoxypyridin-3-yl)oxy-3-methylaniline |
| InChI | InChI=1S/C13H14N2O2/c1-9-7-10(14)3-5-12(9)17-11-4-6-13(16-2)15-8-11/h3-8H,14H2,1-2H3 |
| InChI Key | ADRLSJILFYAVIJ-UHFFFAOYSA-N |
| MDL Number | MFCD30534435 |
| Molecular Formula | C13H14N2O2 |
| Molecular Weight | 230.2625 |
| SMILES | COc1ccc(Oc2ccc(N)cc2C)cn1 |
| Synonyms | 4-((6-methoxypyridin-3-yl)oxy)-3-methylaniline,
871020-35-8,
4-[(6-Methoxy-3-pyridyl)oxy]-3-methylaniline,
SCHEMBL5569420,
MFCD30534435,
CS-0060018,
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| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.267g/mol |
| Monoisotopic Mass | 230.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 57.4A^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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