1-Allyl-1-pyridin-4-yl-but-3-enylaminedihydrochloride CAS 1185299-48-2
| CAS No. | 1185299-48-2 |
| Molecular Formula | C12H16N2 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 1-Allyl-1-pyridin-4-yl-but-3-enylaminedihydrochloride is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
1-Allyl-1-pyridin-4-yl-but-3-enylaminedihydrochloride (CAS 1185299-48-2), molecular formula C12H16N2HCl and molecular weight 224.73 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 1-Allyl-1-pyridin-4-yl-but-3-enylaminedihydrochloride (C12H16N2HCl) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 224.73 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
As a certified reference material (CRM), 1-Allyl-1-pyridin-4-yl-but-3-enylaminedihydrochloride meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C12H16N2 2*HCl |
| Molecular Weight | 224.73 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 2 |
Related Allyl Standards
- 3-Allyl-1H-indole-5-carbonitrile (CAS 1000780-79-9)
- 1-Allyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (CAS 1000801-78-4)
- 5-Allyl-6-chloro-N-(2-fluoro-4-(methylsulfonyl)phenyl)pyrimidin-4-amine (CAS 1001397-14-3)
- 1-Allyl-2-propoxybenzene (CAS 100256-20-0)
- 4-Allyl-2-methoxyphenyl formate (CAS 10031-96-6)
- N-allyl-4-iodo-1-methyl-1H-pyrazole-5-carboxamide (CAS 1005601-97-7)
- 5-Allyl-6-imino-5-(1-methyl-2-pentynyl)hydrouracil (CAS 100705-86-0)
- N-Allyl-N-(cyclohex-1-en-1-yl)aniline (CAS 100747-80-6)
Recommended Standards
- Cyclohexyltriphenylphosphonium Bromide (CAS 7333-51-9)
- Methyl 4-(4-formylphenyl)-2-nitrobenzoate (CAS 1820609-12-8)
- 2-(Pyridin-3-yl)-1-(p-tolyl)ethan-1-one (CAS 224040-91-9)
- N-(p-Tolyl)piperidine-1-sulfonamide (CAS 5450-07-7)
- Ethyl 2-amino-6-phenyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate (CAS 350997-36-3)
- (1-methoxycyclopropyl)methanol (CAS 912346-81-7)
- 5-methyl-1-(oxolan-3-yl)-1H-pyrazol-4-amine (CAS 1374829-61-4)
- 2-(3-Methylpiperazin-1-yl)ethanol (CAS 3366-26-5)
- Methyl 4-(difluoromethoxy)-3-hydroxybenzoate (CAS 1159429-52-3)
- Tirzepatide Impurity 23 X TFA Salt (CAS CATO-C4X-324023)
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