| CAS Number | 1240596-47-7 |
| Catalog Number | AG01DYJX |
| Chemical Name | 2,6-Dichloro-4-methoxynicotinaldehyde |
| IUPAC Name | 2,6-dichloro-4-methoxypyridine-3-carbaldehyde |
| InChI | InChI=1S/C7H5Cl2NO2/c1-12-5-2-6(8)10-7(9)4(5)3-11/h2-3H,1H3 |
| InChI Key | DUHPANFXCPDMCQ-UHFFFAOYSA-N |
| MDL Number | MFCD16988519 |
| Molecular Formula | C7H5Cl2NO2 |
| Molecular Weight | 206.0261 |
| SMILES | ClC1=NC(Cl)=CC(OC)=C1C=O |
| Synonyms | 2,6-Dichloro-4-methoxynicotinaldehyde,
1240596-47-7,
SCHEMBL20241485,
2,6-DICHLORO-4-METHOXYPYRIDINE-3-CARBALDEHYDE,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.022g/mol |
| Monoisotopic Mass | 204.97g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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