| CAS Number | 1340528-88-2 |
| Catalog Number | AG01A8Y8(AGN-PC-0WO7VN) |
| Chemical Name | 3-(1-Methyl-1H-pyrazol-4-yl)piperidine |
| IUPAC Name | 3-(1-methylpyrazol-4-yl)piperidine |
| InChI | InChI=1S/C9H15N3/c1-12-7-9(6-11-12)8-3-2-4-10-5-8/h6-8,10H,2-5H2,1H3 |
| InChI Key | CTNNCYGEVJOKGG-UHFFFAOYSA-N |
| MDL Number | MFCD20306507 |
| Molecular Formula | C9H15N3 |
| Molecular Weight | 165.2355 |
| SMILES | CN1N=CC(C2CNCCC2)=C1 |
| Synonyms | 3-(1-methyl-1H-pyrazol-4-yl)piperidine,
1340528-88-2,
AKOS011693453,
NE51195,
F2167-2876,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.24g/mol |
| Monoisotopic Mass | 165.127g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number