| CAS Number | 1301738-66-8 |
| Catalog Number | AG01AH2L(AGN-PC-0WOUK7) |
| Chemical Name | 5-propyl-1H-pyrazol-3-amine hydrochloride |
| IUPAC Name | 5-propyl-1H-pyrazol-3-amine;hydrochloride |
| InChI | InChI=1S/C6H11N3.ClH/c1-2-3-5-4-6(7)9-8-5;/h4H,2-3H2,1H3,(H3,7,8,9);1H |
| InChI Key | LGXVYJWATARFML-UHFFFAOYSA-N |
| MDL Number | MFCD11111020 |
| Molecular Formula | C6H12ClN3 |
| Molecular Weight | 161.6326 |
| SMILES | Cl.CCCC1NN=C(N)C=1 |
| Synonyms | 5-propyl-1H-pyrazol-3-amine hydrochloride,
1301738-66-8,
SCHEMBL1707357,
MFCD11111020,
AKOS026743868,
MCULE-8839851040,
NE40007,
3-propyl-1H-pyrazol-5-amine hydrochloride,
3-amino-5-n-propyl-1h-pyrazole hydrochloride,
EN300-73506,
Z1266854936,
|
| Complexity | 84.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.633g/mol |
| Monoisotopic Mass | 161.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number