N1-(1,3-benzodioxol-5-yl)-3-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]acrylamide CAS 648859-68-1
| CAS No. | 648859-68-1 |
| Molecular Formula | C15H10ClF6N3O |
| Molecular Weight | 397.70 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
N1-(1,3-benzodioxol-5-yl)-3-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]acrylamide (CAS 648859-68-1), molecular formula C15H10ClF6N3O and molecular weight 397.70 g/mol, is a CATO reference standard with documented purity and traceability.
N1-(1,3-benzodioxol-5-yl)-3-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]acrylamide (C15H10ClF6N3O) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; these physicochemical properties determine the optimal preparation and storage of its standard solutions. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
As a certified reference material (CRM), N1-(1,3-benzodioxol-5-yl)-3-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]acrylamide 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 | C15H10ClF6N3O |
| Molecular Weight | 397.70 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| 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) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 3 |
Related N Standards
- N-[4-(1,3-Benzodioxol-5-yl)-3-cyano-4H-benzo[h]chromen-2-yl]-N,N-dimethyliminoformamide (CAS 860784-59-4)
- 2-(2H-1,3-Benzodioxol-5-yl)-6-chloro-3-iodoimidazo[1,2-a]pyridine (CAS 1426142-80-4)
- 2-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}ethyl)-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-3-one (CAS 861206-88-4)
- 7-(2H-1,3-Benzodioxol-5-yl)-2-(4-tert-butylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CAS 860650-45-9)
- 1-(2H-1,3-Benzodioxol-5-yl)-3-[(4-iodophenyl)amino]propan-1-one (CAS 883794-43-2)
- 4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-(methylsulfanyl)quinazoline (CAS 866137-74-8)
- 4-(2H-1,3-Benzodioxol-5-yl)-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-1,2,3-triazole-5-carbonitrile (CAS 1024414-94-5)
- Methyl 3-(1,3-benzodioxol-5-yl)-3-{[(4-methoxyphenyl)sulfonyl]amino}propanoate (CAS 866144-34-5)
Recommended Standards
- 2-chloro-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]benzamide (CAS 303126-97-8)
- 2-[(4-Chlorophenyl)methyl]-N-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxamide (CAS 478030-43-2)
- (3,5-Bis(trifluoromethyl)phenyl)(2-chloro-6-(dimethylamino)pyrimidin-4-yl)methanone (CAS 1956318-45-8)
- 2-Chloro-N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-phenylacetamide (CAS 565191-95-9)
- Triglyceride Mix 37 (CAS CATO-MCFD201410-TO)
- 2,2,5-Trimethyl-1,3-dioxane-5-carboxylic Acid Vinyl Ester-d3 (CAS 1185176-80-0)
- Methyl 2-ethoxypyridine-3-carboxylate (CAS 74357-21-4)
- Clevidipine-d7 (CAS CATO-C4X-101523)
- (1,3-Benzodioxol-5-ylmethyl)(3-bromobenzyl)amine hydrobromide (CAS 1987244-68-7)
- 4-tert-Butyl-2-methoxybenzaldehyde (CAS 53535-88-9)
- 7-Chlorooxazolo[4,5-b]pyridine (CAS 1782851-31-3)
- tert-Butyl (1-hydroxypent-4-en-2-yl)carbamate (CAS 183247-77-0)
- 1-(5-Methyl-1H-pyrazol-1-yl)ethan-1-one (CAS 114906-08-0)
- Fibrinopeptide A, human TFA (CAS 61533-47-9)
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