| CAS Number | 20737-84-2 |
| Catalog Number | AG00J1WF(AGN-PC-0WB7A7) |
| Chemical Name | 1-Benzyl-3,5-dimethyl-1H-pyrazol-4-amine hydrochloride |
| IUPAC Name | 1-benzyl-3,5-dimethylpyrazol-4-amine;hydrochloride |
| InChI | InChI=1S/C12H15N3.ClH/c1-9-12(13)10(2)15(14-9)8-11-6-4-3-5-7-11;/h3-7H,8,13H2,1-2H3;1H |
| InChI Key | XRFWOWWNONAYDQ-UHFFFAOYSA-N |
| MDL Number | MFCD17430398 |
| Molecular Formula | C12H16ClN3 |
| Molecular Weight | 237.7285 |
| SMILES | N1(CC2=CC=CC=C2)C(C)=C(C(C)=N1)N.Cl |
| Synonyms | 1-BENZYL-3,5-DIMETHYL-1H-PYRAZOL-4-AMINE HYDROCHLORIDE,
20737-84-2,
BB_SC-09162,
ZX-CM006712,
MFCD17430398,
AKOS027426821,
MCULE-4557072285,
|
| Complexity | 201 |
| 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 | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number