| CAS Number | 1242336-72-6 |
| Catalog Number | AG009BQK(AGN-PC-0WRAEL) |
| Chemical Name | 1-(2,6-Dichlorophenyl)-1h-pyrazole |
| IUPAC Name | 1-(2,6-dichlorophenyl)pyrazole |
| InChI | InChI=1S/C9H6Cl2N2/c10-7-3-1-4-8(11)9(7)13-6-2-5-12-13/h1-6H |
| InChI Key | ISWDZQBZQFCRIN-UHFFFAOYSA-N |
| MDL Number | MFCD16660293 |
| Molecular Formula | C9H6Cl2N2 |
| Molecular Weight | 213.0633 |
| SMILES | Clc1cccc(c1n1cccn1)Cl |
| Synonyms | 1-(2,6-dichlorophenyl)-1h-pyrazole,
1242336-72-6,
SCHEMBL6119863,
MFCD16660293,
ZINC65337186,
AKOS027431027,
K-1794,
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| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.061g/mol |
| Monoisotopic Mass | 211.991g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number