| CAS Number | 1282606-18-1 |
| Catalog Number | AG00HRSB(AGN-PC-0WG3VV) |
| Chemical Name | 2-Chloro-4-Dimethylamino-Pyridine-3-Carbaldehyde |
| IUPAC Name | 2-chloro-4-(dimethylamino)pyridine-3-carbaldehyde |
| InChI | InChI=1S/C8H9ClN2O/c1-11(2)7-3-4-10-8(9)6(7)5-12/h3-5H,1-2H3 |
| InChI Key | ZMVRFWZHWPWOER-UHFFFAOYSA-N |
| MDL Number | MFCD21362342 |
| Molecular Formula | C8H9ClN2O |
| Molecular Weight | 184.6229 |
| SMILES | ClC1=C(C=O)C(=CC=N1)N(C)C |
| Synonyms | 1282606-18-1,
2-Chloro-4-(dimethylamino)nicotinaldehyde,
2-Chloro-4-dimethylamino-pyridine-3-carbaldehyde,
2-chloro-4-(dimethylamino)pyridine-3-carbaldehyde,
MFCD21362342,
ZINC238317945,
CS-0037520,
3-Pyridinecarboxaldehyde, 2-chloro-4-(dimethylamino)-,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.623g/mol |
| Monoisotopic Mass | 184.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 33.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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