[(Z)-(1,1,1,5,5,5-Hexafluoro-4-oxopentan-2-ylidene)amino]thiourea CAS 691879-66-0
| CAS No. | 691879-66-0 |
| Molecular Formula | C6H5F6N3OS |
| Molecular Weight | 281.18 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
[(Z)-(1,1,1,5,5,5-Hexafluoro-4-oxopentan-2-ylidene)amino]thiourea (C6H5F6N3OS) contains an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution. Halogen substitution raises its density and boiling point; 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.
[(Z)-(1,1,1,5,5,5-Hexafluoro-4-oxopentan-2-ylidene)amino]thiourea (CAS 691879-66-0), molecular formula C6H5F6N3OS and molecular weight 281.18 g/mol, is a CATO reference standard with documented purity and traceability.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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 | C6H5F6N3OS |
| Molecular Weight | 281.18 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| 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) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
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Recommended Standards
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- Pethidine Impurity 7 (CAS 84176-78-3)
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- 1-(1-Isopropyl-1H-pyrazol-5-yl)-N-((1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-yl)methyl)methanamine hydrochloride (CAS 1856100-71-4)
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- 2-Phenyl-2,3-diazaspiro[4.5]decane-1,4-dione (CAS 16418-56-7)
- 2-(2-(3-Methylcyclopentyl)thiazol-4-yl)acetic acid (CAS 1486945-16-7)
- Methyl 5-oxo-3,5-dihydro-2H-oxazolo[2,3-b]quinazoline-8-carboxylate (CAS 1039454-98-2)
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