| CAS Number | 1909326-24-4 |
| Catalog Number | AG01C1QB |
| Chemical Name | 1-ethyl-N-(2-methylpropyl)-1H-pyrazol-4-amine dihydrochloride |
| IUPAC Name | 1-ethyl-N-(2-methylpropyl)pyrazol-4-amine;dihydrochloride |
| InChI | InChI=1S/C9H17N3.2ClH/c1-4-12-7-9(6-11-12)10-5-8(2)3;;/h6-8,10H,4-5H2,1-3H3;2*1H |
| InChI Key | KDDXWVAOWJFVLB-UHFFFAOYSA-N |
| MDL Number | MFCD29047408 |
| Molecular Formula | C9H19Cl2N3 |
| Molecular Weight | 240.1733 |
| SMILES | Cl.Cl.CCN1N=CC(NCC(C)C)=C1 |
| Synonyms | 1-ethyl-N-(2-methylpropyl)-1H-pyrazol-4-amine dihydrochloride,
1909326-24-4,
Z2238934568,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.172g/mol |
| Monoisotopic Mass | 239.096g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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