2-(3-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole CAS 866051-43-6
| CAS No. | 866051-43-6 |
| Molecular Formula | C21H14F3NS2 |
| Molecular Weight | 401.47 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
2-(3-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole (CAS 866051-43-6) is a high-purity analytical reference standard with the molecular formula C21H14F3NS2 and a molecular weight of 401.47 g/mol.
The molecular framework of 2-(3-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole (C21H14F3NS2) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
As a certified reference material (CRM), 2-(3-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole 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 | C21H14F3NS2 |
| Molecular Weight | 401.47 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 2 |
Related Trifluoromethyl Standards
- 2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole (CAS 400087-79-8)
- 4-[5-(4-{[3-(trifluoromethyl)phenyl]methoxy}phenyl)-1H-pyrazol-3-yl]piperidine (CAS 1137504-05-2)
- 3-[3,5-Bis(trifluoromethyl)phenyl]-1-[2-(morpholin-4-yl)ethyl]thiourea (CAS 220635-34-7)
- 3-Phenyl-6-(trifluoromethyl)-5-{[3-(trifluoromethyl)phenyl]sulfanyl}-1,2,4-triazine (CAS 478048-10-1)
- 2-[2-(Trifluoromethyl)-1H-1,3-benzodiazol-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide (CAS 478080-07-8)
- 3-Methyl-4-[3-(trifluoromethyl)phenyl]-1-{[3-(trifluoromethyl)phenyl]methyl}-4,5-dihydro-1H-1,2,4-triazol-5-one (CAS 861206-74-8)
- 2,2-Bis(trifluoromethyl)-6-iodo-1,1,1-trifluorohexane (CAS 883516-29-8)
- 2,6-bis(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]isonicotinamide (CAS 1092343-95-7)
Recommended Standards
- (S)-Benzyl 2-((tert-butoxycarbonyl)amino)-5-((methylsulfonyl)oxy)pentanoate (CAS 256390-71-3)
- Tert-butyl (S)-2-(((benzyloxy)carbonyl)amino)-5-((methylsulfonyl)oxy)pentanoate (CAS 159877-09-5)
- 3-((4-(Tert-butyl)benzyl)oxy)-N-(2,4-difluorophenyl)thiophene-2-carboxamide (CAS 344270-59-3)
- Tert-butyl 4-(1-cyclopropyl-6-fluoro-2-methyl-4-oxo-1,4-dihydroquinolin-7-yl)piperazine-1-carboxylate (CAS 1429481-63-9)
- 2-(2,2,2-Trifluoroethoxy)cyclopentan-1-amine (CAS 954252-86-9)
- 1-Phenyl-4-(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)piperazine (CAS 339105-50-9)
- 3-(5-Bromo-3-indolyl)-1-propanamine (CAS 54298-70-3)
- Methyl 3-acetamido-4,5-dichlorothiophene-2-carboxylate (CAS 632356-39-9)
- 1-(Tetrahydro-2H-pyran-4-yl)cyclobutane-1-carboxylic acid (CAS 1503518-93-1)
- 5-Amino-3-[4-(trifluoromethyl)phenyl]isoxazole (CAS 81465-84-1)
- 2-[4-[4-(Methylsulfonyl)phenyl]piperazin-1-yl]-ethanol (CAS 166438-70-6)
- 1-(2,5-Difluorophenyl)butan-2-one (CAS 1248068-34-9)
- 1-(Methoxymethyl)cyclobutane-1-sulfonyl chloride (CAS 2138278-39-2)
- Compstatin control peptide (CAS 301544-78-5)
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