| CAS Number | 1375069-08-1 |
| Catalog Number | AG009X3Z(AGN-PC-0WA7D7) |
| Chemical Name | 3-(4-Bromo-1H-Pyrazol-1-Yl)Piperidine Hydrochloride |
| IUPAC Name | 3-(4-bromopyrazol-1-yl)piperidine;hydrochloride |
| InChI | InChI=1S/C8H12BrN3.ClH/c9-7-4-11-12(6-7)8-2-1-3-10-5-8;/h4,6,8,10H,1-3,5H2;1H |
| InChI Key | XUEJTWRHSYRZTB-UHFFFAOYSA-N |
| MDL Number | MFCD22205770 |
| Molecular Formula | C8H13BrClN3 |
| Molecular Weight | 266.5659 |
| SMILES | BrC1=CN(C2CNCCC2)N=C1.[H]Cl |
| Synonyms | 1375069-08-1,
3-(4-BROMOPYRAZOL-1-YL)PIPERIDINE, HCL,
3-(4-Bromopyrazol-1-yl)piperidine hydrochloride,
C8H13BrClN3,
SCHEMBL16899733,
MFCD22205770,
3-(4-Bromopyrazol-1-yl)piperidine HCl,
CS-0086816,
V2754,
B-8434,
3-(4-Bromo-1H-pyrazol-1-yl)piperidine hydrochloride,
3-(4-Bromo-1H-pyrazol-1-yl)piperidine hydrochloride, AldrichCPR,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.998g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.567g/mol |
| Monoisotopic Mass | 264.998g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number