| CAS Number | 1261975-11-4 |
| Catalog Number | AG00HP68(AGN-PC-0WR6TK) |
| Chemical Name | 2-(4-Benzyloxyphenyl)-4-hydroxypyridine |
| IUPAC Name | 2-(4-phenylmethoxyphenyl)-1H-pyridin-4-one |
| InChI | InChI=1S/C18H15NO2/c20-16-10-11-19-18(12-16)15-6-8-17(9-7-15)21-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,19,20) |
| InChI Key | XTVSBONXQKYXBB-UHFFFAOYSA-N |
| MDL Number | MFCD18323816 |
| Molecular Formula | C18H15NO2 |
| Molecular Weight | 277.3172 |
| SMILES | Oc1ccnc(c1)c1ccc(cc1)OCc1ccccc1 |
| Synonyms | 1261975-11-4,
2-(4-BENZYLOXYPHENYL)-4-HYDROXYPYRIDINE,
2-(4-(Benzyloxy)phenyl)pyridin-4-ol,
DTXSID30692790,
MFCD18323816,
2-[4-(Benzyloxy)phenyl]pyridin-4(1H)-one,
2-(4-(benzyloxy)phenyl)pyridin-4(1H)-one,
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| Complexity | 413 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.323g/mol |
| Monoisotopic Mass | 277.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
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