| CAS Number | 1138218-02-6 |
| Catalog Number | AG00HCQX(AGN-PC-0WOW23) |
| Chemical Name | 4-(1-methyl-1H-pyrazol-4-yl)piperidine |
| IUPAC Name | 4-(1-methylpyrazol-4-yl)piperidine |
| InChI | InChI=1S/C9H15N3/c1-12-7-9(6-11-12)8-2-4-10-5-3-8/h6-8,10H,2-5H2,1H3 |
| InChI Key | IUDLSNKWDQBFQL-UHFFFAOYSA-N |
| MDL Number | MFCD11899351 |
| Molecular Formula | C9H15N3 |
| Molecular Weight | 165.2355 |
| SMILES | Cn1ncc(c1)C1CCNCC1 |
| Synonyms | 4-(1-methyl-1H-pyrazol-4-yl)piperidine,
1138218-02-6,
AC1Q3YST,
SCHEMBL17940604,
MFCD11899351,
ZINC33487581,
AKOS011693450,
MCULE-2991963956,
NE40965,
AJ-86152,
BS-13609,
EN300-62898,
F2167-2442,
Z1262254310,
4-(1-methylpyrazol-4-yl)piperidine,
|
| Complexity | 143 |
| 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 | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number