| CAS Number | 1225599-53-0 |
| Catalog Number | AG01E6J2 |
| Chemical Name | 1-(3,5-dichlorophenyl)-3-methyl-1H-pyrazol-5-amine |
| IUPAC Name | 2-(3,5-dichlorophenyl)-5-methylpyrazol-3-amine |
| InChI | InChI=1S/C10H9Cl2N3/c1-6-2-10(13)15(14-6)9-4-7(11)3-8(12)5-9/h2-5H,13H2,1H3 |
| InChI Key | CHRKCTSHSRJNHC-UHFFFAOYSA-N |
| MDL Number | MFCD16321857 |
| Molecular Formula | C10H9Cl2N3 |
| Molecular Weight | 242.1046 |
| SMILES | CC1=NN(C2=CC(Cl)=CC(Cl)=C2)C(N)=C1 |
| Synonyms | SCHEMBL18694553,
1-(3,5-dichlorophenyl)-3-methyl-1H-pyrazol-5-amine,
1225599-53-0,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.103g/mol |
| Monoisotopic Mass | 241.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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