N-(3,5-Bis(trifluoromethyl)phenyl)-1-(diphenylphosphoryl)methanethioamide CAS 646497-38-3
| CAS No. | 646497-38-3 |
| Molecular Formula | C21H14F6NOPS |
| Molecular Weight | 473.37 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
N-(3,5-Bis(trifluoromethyl)phenyl)-1-(diphenylphosphoryl)methanethioamide (CAS 646497-38-3) is a high-purity analytical reference standard with the molecular formula C21H14F6NOPS and a molecular weight of 473.37 g/mol.
N-(3,5-Bis(trifluoromethyl)phenyl)-1-(diphenylphosphoryl)methanethioamide (C21H14F6NOPS) contains a steroid core, an amide group, sulfur-containing functionality, organophosphorus functionality, a hydroxyl group, an ether linkage, 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. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 Formula | C21H14F6NOPS |
| Molecular Weight | 473.37 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 12.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Recommended Standards
- Methyl 2-(2-(2,4-dichlorophenoxy)acetamido)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate (CAS 505096-56-0)
- 2-((4-(2,4-Dichlorophenyl)-5-((naphthalen-1-ylamino)methyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide (CAS 1306738-78-2)
- 3-(4-((2,4-Dichlorobenzyl)oxy)phenyl)-1-tosyl-1H-pyrazole (CAS 477711-59-4)
- Enasidenib (CAS 1446502-11-9)
- 2-Acetoxy-3,5-methoxybenzophenone (CAS 890098-98-3)
- Ethyl 2-({6-[(benzenesulfonyl)methyl]-2-phenylpyrimidin-4-yl}sulfanyl)acetate (CAS 303147-42-4)
- 5-Methyl-2-phenylfuran-3-carbaldehyde (CAS 157836-53-8)
- 2,5,8-Trimethylquinolin-4-amine (CAS 948292-44-2)
- 5-[1-Furan-2-yl-meth-(Z)-ylidene]-imidazolidine-2,4-dione (CAS 136949-32-1)
- 3-(2-Fluorophenyl)-6-methoxy-2-(trifluoromethyl)pyridine (CAS 1214349-63-9)
- 3-Amino-n-ethyl-5-methylbenzenesulfonamide (CAS 1017430-12-4)
- (1R,2S)-2-(methylamino)-1,2-diphenylethan-1-ol (CAS 20616-52-8)
- 4-Methyl-4-phenylpentan-2-one (CAS 7403-42-1)
- endo-Gly31-Semaglutide (CAS CATO-C4X-2226282)
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