| CAS Number | 1354952-72-9 |
| Catalog Number | AG019SIS(AGN-PC-0WO5JA) |
| Chemical Name | 2-chloro-5-(3,5-dimethyl-1H-pyrazol-1-yl)pyridine |
| IUPAC Name | 2-chloro-5-(3,5-dimethylpyrazol-1-yl)pyridine |
| InChI | InChI=1S/C10H10ClN3/c1-7-5-8(2)14(13-7)9-3-4-10(11)12-6-9/h3-6H,1-2H3 |
| InChI Key | PPJSYJLCCJUUOH-UHFFFAOYSA-N |
| MDL Number | MFCD20731110 |
| Molecular Formula | C10H10ClN3 |
| Molecular Weight | 207.6595 |
| SMILES | CC1=NN(C2=CN=C(Cl)C=C2)C(C)=C1 |
| Synonyms | 2-chloro-5-(3,5-dimethyl-1H-pyrazol-1-yl)pyridine,
1354952-72-9,
ZINC71790448,
AKOS026727909,
NE19689,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.661g/mol |
| Monoisotopic Mass | 207.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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