| CAS Number | 1107604-11-4 |
| Catalog Number | AG008RUT(AGN-PC-0WRASK) |
| Chemical Name | C-(1-Benzyl-1H-pyrazol-4-YL)-methylamine hydrochloride |
| IUPAC Name | (1-benzylpyrazol-4-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C11H13N3.ClH/c12-6-11-7-13-14(9-11)8-10-4-2-1-3-5-10;/h1-5,7,9H,6,8,12H2;1H |
| InChI Key | JMALFIQRGBHOSS-UHFFFAOYSA-N |
| MDL Number | MFCD06739004 |
| Molecular Formula | C11H14ClN3 |
| Molecular Weight | 223.702 |
| SMILES | N1(CC2C=CC=CC=2)C=C(C=N1)CN.Cl |
| Synonyms | C-(1-BENZYL-1H-PYRAZOL-4-YL)-METHYLAMINE HYDROCHLORIDE,
1107604-11-4,
(1-BENZYL-1H-PYRAZOL-4-YL)METHANAMINE HYDROCHLORIDE,
ZX-CM010926,
3874AJ,
MFCD06739004,
AB28361,
Z-4996,
1-(1-Benzyl-1H-pyrazol-4-yl)methanamine AldrichCPR,
c-(1-benzyl-1h-pyrazol-4-yl)methylamine hydrochloride,
[(1-Benzyl-1H-pyrazol-4-yl)methyl]amine hydrochloride,
C11H13N3.HCl,
936940-11-3,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.704g/mol |
| Monoisotopic Mass | 223.088g/mol |
| Rotatable Bond Count | 3 |
| 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