| CAS Number | 1211587-25-5 |
| Catalog Number | AG009GJO |
| Chemical Name | 2-Ethoxyisonicotinaldehyde |
| IUPAC Name | 2-ethoxypyridine-4-carbaldehyde |
| InChI | InChI=1S/C8H9NO2/c1-2-11-8-5-7(6-10)3-4-9-8/h3-6H,2H2,1H3 |
| InChI Key | JNDJQCGMRNGGQA-UHFFFAOYSA-N |
| MDL Number | MFCD17012139 |
| Molecular Formula | C8H9NO2 |
| Molecular Weight | 151.1626 |
| SMILES | C(C)OC=1C=C(C=O)C=CN1 |
| Synonyms | 1211587-25-5,
2-Ethoxypyridine-4-carboxaldehyde,
2-ethoxypyridine-4-carbaldehyde,
2-Ethoxy-4-carboxaldehyde,
SCHEMBL7399408,
DTXSID80628887,
4-Pyridinecarboxaldehyde, 2-ethoxy-,
ZINC71256427,
2-ethoxyisonicotinaldehyde,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.165g/mol |
| Monoisotopic Mass | 151.063g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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