| CAS Number | 1350443-30-9 |
| Catalog Number | AG009VIX |
| Chemical Name | Methyl-(2H-pyrazol-3-ylmethyl)-amine dihydrochloride |
| IUPAC Name | N-methyl-1-(1H-pyrazol-5-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C5H9N3.2ClH/c1-6-4-5-2-3-7-8-5;;/h2-3,6H,4H2,1H3,(H,7,8);2*1H |
| InChI Key | FLRNDMIQAXQZTR-UHFFFAOYSA-N |
| MDL Number | MFCD09997876 |
| Molecular Formula | C5H11Cl2N3 |
| Molecular Weight | 184.0669 |
| SMILES | CNCC1=NNC=C1.Cl.Cl |
| Synonyms | 1350443-30-9,
METHYL-(2H-PYRAZOL-3-YLMETHYL)-AMINE DIHYDROCHLORIDE,
N-Methyl-1H-pyrazole-3-methanamine 2HCl,
N-Methyl-1-(1H-pyrazol-3-yl)methanamine dihydrochloride,
N-methyl-1-(1H-pyrazol-5-yl)methanamine dihydrochloride,
MFCD09997876,
AKOS015958976,
AKOS027251455,
NE62895,
AS-32862,
Methyl-(2H-pyrazol-3-ylmethyl)amine dihydrochloride,
methyl[(1H-pyrazol-5-yl)methyl]amine dihydrochloride,
3-methylaminomethyl-2h-pyrazole,
methyl-(2h-pyrazol-3-ylmethyl)-amine,
676491-02-4,
|
| Complexity | 64.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.064g/mol |
| Monoisotopic Mass | 183.033g/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