5-{[(3-methoxyphenyl)methyl]amino}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile CAS 318517-84-9

Purity 97%+In StockPharmaceutical Standards
CAS No.318517-84-9
Molecular FormulaC14H13F3N4O
Molecular Weight310.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-{[(3-methoxyphenyl)methyl]amino}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile CAS 318517-84-9 chemical structure

Description

CATO manufactures 5-{[(3-methoxyphenyl)methyl]amino}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

CATO supplies 5-{[(3-methoxyphenyl)methyl]amino}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile (CAS 318517-84-9), a certified reference material (molecular formula C14H13F3N4O, MW 310.27 g/mol) for analytical method development and quality control.

Structurally, 5-{[(3-methoxyphenyl)methyl]amino}-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile (C14H13F3N4O) 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 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 310.27 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).

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.

Physical & Chemical Properties

Molecular FormulaC14H13F3N4O
Molecular Weight310.27 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing
Nitrogen Atoms4

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