| CAS Number | 1172384-23-4 |
| Catalog Number | AG000DYH(AGN-PC-0WB6WG) |
| Chemical Name | [2-(1H-Pyrazol-1-yl)propyl]amine hydrochloride |
| IUPAC Name | 2-pyrazol-1-ylpropan-1-amine |
| InChI | InChI=1S/C6H11N3/c1-6(5-7)9-4-2-3-8-9/h2-4,6H,5,7H2,1H3 |
| InChI Key | GQZZHLYLVWFBAY-UHFFFAOYSA-N |
| MDL Number | MFCD10001523 |
| Molecular Formula | C6H11N3 |
| Molecular Weight | 125.1716 |
| SMILES | CC(N1N=CC=C1)CN |
| Synonyms | 2-(1H-pyrazol-1-yl)propan-1-amine,
1172384-23-4,
2-pyrazol-1-ylpropan-1-amine,
2-pyrazolylpropylamine,
SCHEMBL1696877,
DTXSID80649476,
GQZZHLYLVWFBAY-UHFFFAOYSA-N,
ALBB-021590,
[2-(1H-Pyrazol-1-yl)propyl]amine,
MFCD10001523,
SBB025921,
STK352851,
AKOS005168307,
MCULE-1844920773,
1H-Pyrazole-1-ethanamine, beta-methyl-,
ST45134945,
2-(1H-PYRAZOL-1-YL)-1-PROPANAMINE,
Y-6265,
[2-(1H-Pyrazol-1-yl)propyl]aminedihydrochloride,
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| Complexity | 84.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.175g/mol |
| Monoisotopic Mass | 125.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number