1-(4-Bromophenyl)-3-((3-(trifluoromethyl)benzyl)thio)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile CAS 861209-35-0
| CAS No. | 861209-35-0 |
| Molecular Formula | C23H16BrF3N2S |
| Molecular Weight | 489.35 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 489.35 g/mol gives 1-(4-Bromophenyl)-3-((3-(trifluoromethyl)benzyl)thio)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 1-(4-Bromophenyl)-3-((3-(trifluoromethyl)benzyl)thio)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile (CAS 861209-35-0), a certified reference material (molecular formula C23H16BrF3N2S, MW 489.35 g/mol) for analytical method development and quality control.
Structurally, 1-(4-Bromophenyl)-3-((3-(trifluoromethyl)benzyl)thio)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile (C23H16BrF3N2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 15.0, corresponding to approximately 15 ring(s) or double-bond equivalent(s). With a molecular weight of 489.35 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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-(4-Bromophenyl)-3-((3-(trifluoromethyl)benzyl)thio)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile 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 | C23H16BrF3N2S |
| Molecular Weight | 489.35 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.) | 1987 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Bromophenyl Standards
- 4'-(2-Bromophenyl)-1'-methyl-1'',2,2'',4-tetrahydrodispiro[1-benzopyran-3,3'-pyrrolidine-2',3''-indole]-2'',4-dione (CAS 1177910-05-2)
- 5-(4-Bromophenyl)-3-(tert-butyl)-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-one (CAS 1424941-67-2)
- 5-(3-Bromophenyl)-9-chloro-2-(naphthalen-2-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine (CAS 303060-30-2)
- 4,7-Bis(4-bromophenyl)-1,10-phenanthroline (CAS 97802-08-9)
- 1,2-Di(4-bromophenyl)-1,2-diphenylethylene (CAS 184239-35-8)
- 2-(4-Bromophenyl)-4,6-di-2-naphthalenyl -1,3,5-Triazine (CAS 1616841-66-7)
- 5-(4-Bromophenyl)-3-hydroxy-4-(4-isopropoxy-3-methylbenzoyl)-1-(2-methoxyethyl)-1H-pyrrol-2(5H)-one (CAS 371130-31-3)
- N-(4-(4-Bromophenyl)thiazol-2-yl)-2-(methylthio)-N-((tetrahydrofuran-2-yl)methyl)nicotinamide (CAS 950064-08-1)
Recommended Standards
- 1H-indole, 3-iodo-4-(phenylmethoxy)-1-(phenylsulfonyl)- (CAS 880872-14-0)
- Ethyl 5-(3,4-dichlorophenyl)-2-(4-(4-nitrophenyl)piperazin-1-yl)-1H-pyrrole-3-carboxylate (CAS 338406-41-0)
- SBI-0206965 (CAS 1884220-36-3)
- NHPI-PEG2-C2-Pfp ester (CAS 2101206-47-5)
- N-(4-(4-(Methylsulfonyl)piperazine-1-carbonyl)oxazol-2-yl)thiophene-2-carboxamide (CAS 1286700-04-6)
- 3-(3-Fluorophenyl)-2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid (CAS 1204297-72-2)
- MergocriptineDiscontinued (CAS 81968-16-3)
- Ethyl (R)-5-methyl-4-oxo-5-(trifluoromethyl)-4,5-dihydrofuran-2-carboxylate (CAS 2878423-90-4)
- 2-Amino-5-(hydroxymethyl)phenol (CAS 114484-31-0)
- Selexipag Impurity 46 (CAS 42042-66-0)
- 206659-00-9 8-Anilinonaphthalene-1-sulfonic acid--ammonia--water (1/1/1) DTXSID90746586 (CAS 206659-00-9)
- (6-Ethoxypyridin-3-yl)methanamine (CAS 591771-82-3)
- tert-Butyl 5-bromo-3-oxo-2h-indazole-1-carboxylate (CAS 1260782-03-3)
- D-[Thr]5-Semaglutide (CAS CATO-C4X-2226245)
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