| CAS Number | 1909327-84-9 |
| Catalog Number | AG01C4M9 |
| Chemical Name | methyl[(3-methyl-1H-pyrazol-4-yl)methyl]amine dihydrochloride |
| IUPAC Name | N-methyl-1-(5-methyl-1H-pyrazol-4-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C6H11N3.2ClH/c1-5-6(3-7-2)4-8-9-5;;/h4,7H,3H2,1-2H3,(H,8,9);2*1H |
| InChI Key | ODSNHYQJSOINHB-UHFFFAOYSA-N |
| MDL Number | MFCD29906931 |
| Molecular Formula | C6H13Cl2N3 |
| Molecular Weight | 198.0935 |
| SMILES | Cl.Cl.CNCC1C(C)=NNC=1 |
| Synonyms | methyl[(3-methyl-1H-pyrazol-4-yl)methyl]amine dihydrochloride,
1909327-84-9,
AKOS030757879,
Z2429425694,
|
| Complexity | 84.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.091g/mol |
| Monoisotopic Mass | 197.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number