| CAS Number | 819069-58-4 |
| Catalog Number | AG01A60V(AGN-PC-0NHGBK) |
| Chemical Name | 6-Methoxy-2,4-dimethylpyridine-3-carbaldehyde |
| IUPAC Name | 6-methoxy-2,4-dimethylpyridine-3-carbaldehyde |
| InChI | InChI=1S/C9H11NO2/c1-6-4-9(12-3)10-7(2)8(6)5-11/h4-5H,1-3H3 |
| InChI Key | KIUBLPCMTJOZOA-UHFFFAOYSA-N |
| MDL Number | MFCD18802885 |
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.1891 |
| SMILES | COC1=NC(C)=C(C=O)C(C)=C1 |
| Synonyms | 6-methoxy-2,4-dimethylpyridine-3-carbaldehyde,
819069-58-4,
ZINC38350324,
AKOS026727006,
NE53804,
2,4-dimethyl-6-methoxynicotinaldehyde,
CID11194530,
6-methoxy-2,4-dimethyl-pyridine-3-carbaldehyde,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.192g/mol |
| Monoisotopic Mass | 165.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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