3-benzyl-3-azabicyclo[3.1.1]heptan-6-one hydrochloride CAS 1803581-83-0
| CAS No. | 1803581-83-0 |
| Molecular Formula | C13H15NO |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
3-benzyl-3-azabicyclo[3.1.1]heptan-6-one hydrochloride (CAS 1803581-83-0), molecular formula C13H15NOHCl and molecular weight 237.73 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of 3-benzyl-3-azabicyclo[3.1.1]heptan-6-one hydrochloride (C13H15NOHCl) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C13H15NO HCl |
| Molecular Weight | 237.73 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1995 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
Related benzyl Standards
- 1-{1-azabicyclo[2.2.2]octan-3-yl}-2,5-dimethyl-1h-pyrrole-3-carboxylic acid (CAS 1000930-76-6)
- Methyl 1-{1-azabicyclo[2.2.2]octan-3-yl}-2,5-dimethyl-1h-pyrrole-3-carboxylate (CAS 1000932-03-5)
- 3-Benzyl-3-azabicyclo[4.1.0]heptan-6-amine (CAS 1000934-01-9)
- 9-Oxa-3-azabicyclo[3.3.1]nonane hydrochloride (CAS 100368-29-4)
- 3-Oxa-9-azabicyclo[3.3.1]Nonan-7-ol (CAS 100368-36-3)
- 6-Methyl-2-azabicyclo[2.2.0]hex-5-en-3-one (CAS 100465-35-8)
- 2-phenyl-3-azabicyclo[3.2.1]octane (CAS 100608-29-5)
- 1-(8-Azabicyclo[3.2.1]oct-3-yl)benzimidazole (CAS 1009075-42-6)
Recommended Standards
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- (2R,3R,4S,5R)-2-(6-Amino-8-(methylselanyl)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (CAS 52109-41-8)
- N-(5-(tert-butyl)-1H-pyrazol-3-yl)pivalamide (CAS 84958-61-2)
- 4-Nitro-[1,1':3',1''-terphenyl]-5'-ol (CAS 98124-35-7)
- 1-(Tert-butyl) 5-ethyl 3-bromo-1H-indazole-1,5-dicarboxylate (CAS 1547025-27-3)
- 1-[4-(4-Methoxybenzoyl)-1,2-oxazol-3-yl]ethan-1-one (CAS 338954-27-1)
- 2-Methyl-1-(naphthalen-2-yl)propan-2-amine hydrochloride (CAS 351490-95-4)
- 3-Cyclopropoxy-6-isopropylpicolinic acid (CAS 1243288-39-2)
- Semaglutide impurity 200 (CAS CATO-C4X-2226200)
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