3-((3-Methylbenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS 692287-37-9
| CAS No. | 692287-37-9 |
| Molecular Formula | C25H21F3N2S |
| Molecular Weight | 438.51 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 438.51 g/mol gives 3-((3-Methylbenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 3-((3-Methylbenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 692287-37-9), a certified reference material (molecular formula C25H21F3N2S, MW 438.51 g/mol) for analytical method development and quality control.
3-((3-Methylbenzyl)thio)-1-(3-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (C25H21F3N2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine 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 aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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.
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 | C25H21F3N2S |
| Molecular Weight | 438.51 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, 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) | 15.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Methylbenzyl Standards
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Recommended Standards
- 11ß-Hydroxycedrelone (CAS 283174-18-5)
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- 1-(2,4,6-Tris(benzyloxy)phenyl)ethanone (CAS 61497-71-0)
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- 1-Acetyl-3,4-dihydroquinolin-2(1H)-one (CAS 229496-38-2)
- 33432-53-0 2-methyl-4-(4-nitrophenyl)but-3-yn-2-ol DTXSID10400799 (CAS 33432-53-0)
- Epipolygodial (CAS 5956-39-8)
- 2-(3-((N-(4-(1H-pyrazol-1-yl)benzyl)pyridine-3-sulfonamido)methyl)phenoxy)acetic acid (CAS 752187-80-7)
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- Dendroaspis Natriuretic Peptide (CAS 255721-52-9)
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