Methyl 4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzoate CAS 896160-80-8
| CAS No. | 896160-80-8 |
| Molecular Formula | C15H19F3N2O2 |
| Molecular Weight | 316.32 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including Methyl 4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzoate.
Methyl 4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzoate (CAS 896160-80-8), molecular formula C15H19F3N2O2 and molecular weight 316.32 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, Methyl 4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzoate (C15H19F3N2O2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 316.32 g/mol, it falls into the moderately-high-molecular-weight range. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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.
Physical & Chemical Properties
| Molecular Formula | C15H19F3N2O2 |
| Molecular Weight | 316.32 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Related Methyl Standards
- 2-(4-Methylpiperazin-1-yl)-4-oxo-4-[4-(propan-2-yl)phenyl]butanoic acid (CAS 329701-93-1)
- Ethyl 4-(3-((4-methylpiperazin-1-yl)methyl)phenyl)-4-oxobutanoate (CAS 898789-47-4)
- 898763-57-0 Ethyl 4-{4-[(4-methylpiperazin-1-yl)methyl]phenyl}-4-oxobutanoate DTXSID30643005 (CAS 898763-57-0)
- 2-((4-Methylpiperazin-1-yl)methyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(1H)-one (CAS 20886-99-1)
- 2-(3-((4-Methylpiperazin-1-yl)methyl)benzoyl)benzonitrile (CAS 898788-42-6)
- 2-(4-((4-Methylpiperazin-1-yl)methyl)benzoyl)benzonitrile (CAS 898783-49-8)
- 2-(4-Methylpiperazin-1-yl)-1-phenyl-1H-indole-3-carbaldehyde (CAS 63925-79-1)
- 3-(3-((4-Methylpiperazin-1-yl)methyl)benzoyl)benzonitrile (CAS 898788-44-8)
Recommended Standards
- Methyl 2-(4-fluorophenyl)-4-(3-methoxyphenyl)-4-oxobutanoate (CAS 344280-52-0)
- N-(3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-3-(trifluoromethyl)benzamide (CAS 318498-20-3)
- Ethyl 7-oxo-7-(4-trifluoromethylphenyl)heptanoate (CAS 898777-85-0)
- N-(3-morpholinopropyl)-2-(trifluoromethyl)benzamide (CAS 942473-88-3)
- Imidazo[1,2-a]pyridine-3-carboxylic Acid (CAS 6200-60-8)
- 1-(Aminomethyl)-4,4-difluorocyclohexane Hydrochloride (CAS 809273-65-2)
- 2-Chloro-5-nitro-N-(tetrahydro-2H-pyran-4-yl)pyrimidin-4-amine (CAS 899806-21-4)
- 1-(5-Aminoisoxazol-3-yl)ethanone (CAS 1558335-05-9)
- MeOSuc-Ala-Ala-Pro-Val-OH (H-3748.0050) (CAS 107441-48-5)
- 7,8-Dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (CAS 2243674-33-9)
- tert-Butyl 4-carbamothioylpiperazine-1-carboxylate (CAS 196811-66-2)
- 2-(4-Benzylpiperazin-1-yl)-N-(2-ethoxyphenyl)acetamide (CAS 647031-45-6)
- (S)-3-(3-Methoxyphenyl)pyrrolidine hydrochloride (CAS 1384268-73-8)
- Semaglutide Impurity 142 (CAS CATO-C4X-2226142)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com