| CAS Number | 1609400-41-0 |
| Catalog Number | AG00J18V(AGN-PC-0WB6TK) |
| Chemical Name | N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-2-methyl-1-propanamine hydrochloride |
| IUPAC Name | N-[(1-ethylpyrazol-4-yl)methyl]-2-methylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C10H19N3.ClH/c1-4-13-8-10(7-12-13)6-11-5-9(2)3;/h7-9,11H,4-6H2,1-3H3;1H |
| InChI Key | KRFDWRQDDGRKFW-UHFFFAOYSA-N |
| MDL Number | MFCD13186156 |
| Molecular Formula | C10H20ClN3 |
| Molecular Weight | 217.7389 |
| SMILES | N1=CC(=CN1CC)CNCC(C)C.Cl |
| Synonyms | 1609400-41-0,
N-[(1-Ethyl-1H-pyrazol-4-yl)methyl]-2-methyl-1-propanamine hydrochloride,
N-((1-Ethyl-1H-pyrazol-4-yl)methyl)-2-methylpropan-1-amine hydrochloride,
ZX-CM003527,
MFCD13186156,
AKOS027426605,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.135g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.741g/mol |
| Monoisotopic Mass | 217.135g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number