| CAS Number | 1049750-94-8 |
| Catalog Number | AG019J5E |
| Chemical Name | 1-(2,5-dimethylphenyl)-3-methyl-1H-pyrazol-5-amine hydrochloride |
| IUPAC Name | 2-(2,5-dimethylphenyl)-5-methylpyrazol-3-amine;hydrochloride |
| InChI | InChI=1S/C12H15N3.ClH/c1-8-4-5-9(2)11(6-8)15-12(13)7-10(3)14-15;/h4-7H,13H2,1-3H3;1H |
| InChI Key | JMFARHZEJRACPS-UHFFFAOYSA-N |
| MDL Number | MFCD08445282 |
| Molecular Formula | C12H16ClN3 |
| Molecular Weight | 237.7285 |
| SMILES | Cl.CC1=NN(C2=C(C)C=CC(C)=C2)C(N)=C1 |
| Synonyms | 1-(2,5-dimethylphenyl)-3-methyl-1H-pyrazol-5-amine hydrochloride,
1049750-94-8,
AC1Q39JA,
CTK6B7105,
NE60325,
EN300-08609,
|
| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.731g/mol |
| Monoisotopic Mass | 237.103g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number