| CAS Number | 1622840-25-8 |
| Catalog Number | AG01EL5W |
| Chemical Name | 2,4-dichloro-5-(propan-2-yl)pyridine |
| IUPAC Name | 2,4-dichloro-5-propan-2-ylpyridine |
| InChI | InChI=1S/C8H9Cl2N/c1-5(2)6-4-11-8(10)3-7(6)9/h3-5H,1-2H3 |
| InChI Key | IHTRMUMBLQKTGV-UHFFFAOYSA-N |
| MDL Number | MFCD28054791 |
| Molecular Formula | C8H9Cl2N |
| Molecular Weight | 190.0698 |
| SMILES | CC(C1=C(Cl)C=C(Cl)N=C1)C |
| Synonyms | SCHEMBL18353218,
2,4-dichloro-5-propan-2-ylpyridine,
1622840-25-8,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.067g/mol |
| Monoisotopic Mass | 189.011g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
Lot Number