| CAS Number | 1106959-86-7 |
| Catalog Number | AG009723 |
| Chemical Name | 1H-Pyrazole-4-methanamine, 1-phenyl-, hydrochloride |
| IUPAC Name | (1-phenylpyrazol-4-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C10H11N3.ClH/c11-6-9-7-12-13(8-9)10-4-2-1-3-5-10;/h1-5,7-8H,6,11H2;1H |
| InChI Key | VUXNCPAUTHHANH-UHFFFAOYSA-N |
| MDL Number | MFCD13186274 |
| Molecular Formula | C10H12ClN3 |
| Molecular Weight | 209.6754 |
| SMILES | NCC1=CN(C2=CC=CC=C2)N=C1.[H]Cl |
| Synonyms | [(1-Phenyl-1H-pyrazol-4-yl)methyl]amine hydrochloride,
1106959-86-7,
AG-664/25098041,
ZX-CM014346,
MFCD13186274,
1H-Pyrazole-4-methanamine, 1-phenyl-, hydrochloride,
1-(1-Phenyl-1H-pyrazol-4-yl)methanamine hydrochloride,
1-(1-Phenyl-1H-pyrazol-4-yl)methanamine hydrochloride, AldrichCPR,
(1-phenylpyrazol-4-yl)methanamine;hydrochloride,
400877-10-3,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.677g/mol |
| Monoisotopic Mass | 209.072g/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