| CAS Number | 1193388-04-3 |
| Catalog Number | AG019WLW |
| Chemical Name | [1-(4-methoxyphenyl)-1H-pyrazol-3-yl]methanamine hydrochloride |
| IUPAC Name | [1-(4-methoxyphenyl)pyrazol-3-yl]methanamine;hydrochloride |
| InChI | InChI=1S/C11H13N3O.ClH/c1-15-11-4-2-10(3-5-11)14-7-6-9(8-12)13-14;/h2-7H,8,12H2,1H3;1H |
| InChI Key | SUNXKMPXDBNVDQ-UHFFFAOYSA-N |
| MDL Number | MFCD22076825 |
| Molecular Formula | C11H14ClN3O |
| Molecular Weight | 239.7014 |
| SMILES | Cl.COC1=CC=C(N2N=C(CN)C=C2)C=C1 |
| Synonyms | [1-(4-methoxyphenyl)-1H-pyrazol-3-yl]methanamine hydrochloride,
1193388-04-3,
AC1Q3C33,
MCULE-7608202559,
NE28714,
EN300-52363,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.703g/mol |
| Monoisotopic Mass | 239.083g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 53.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number