2-((3,3,3-Trifluoropropyl)thio)acetonitrile CAS 1086602-99-4
| CAS No. | 1086602-99-4 |
| Molecular Formula | C5H6F3NS |
| Molecular Weight | 169.17 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 2-((3,3,3-Trifluoropropyl)thio)acetonitrile.
2-((3,3,3-Trifluoropropyl)thio)acetonitrile (CAS 1086602-99-4) is a high-purity analytical reference standard with the molecular formula C5H6F3NS and a molecular weight of 169.17 g/mol.
Based on its molecular formula C5H6F3NS, 2-((3,3,3-Trifluoropropyl)thio)acetonitrile contains a nitrile group, sulfur-containing functionality, fluorine substitution; these features give the compound characteristic molecular-ion distribution patterns in mass spectrometry. The molecular weight of 169.17 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), 2-((3,3,3-Trifluoropropyl)thio)acetonitrile 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 | C5H6F3NS |
| Molecular Weight | 169.17 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 2.0 |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related Trifluoropropyl Standards
- 3-(3,3,3-Trifluoropropyl)azetidin-3-ol (CAS 1496191-77-5)
- 2-(3,3,3-Trifluoropropyl)-1,3-dioxolane (CAS 773102-97-9)
- 1-(3,3,3-Trifluoropropyl)azetidin-3-amine (CAS 1342697-73-7)
- n-(3,3,3-Trifluoropropyl)cyclobutanamine (CAS 1344091-41-3)
- 2-(3,3,3-Trifluoropropyl)pyrrolidine (CAS 1488647-61-5)
- 3-[(3,3,3-trifluoropropyl)amino]propanenitrile (CAS 1170012-74-4)
- 2-((3,3,3-Trifluoropropyl)thio)ethanamine (CAS 1343672-04-7)
- 5-(3,3,3-Trifluoropropyl)-1H-imidazole (CAS 2228304-27-4)
Recommended Standards
- 6,7-Difluoro-2,3-dihydro-1H-inden-1-amine (CAS 1071449-17-6)
- 1-Amino-3,3-difluoro-2,3-dihydro-1H-indene (CAS 1196156-50-9)
- Ticagrelor Impurity 121 (CAS 1006614-49-8)
- 3-(3,5-Difluorophenyl)azetidine (CAS 1203796-99-9)
- N-Boc-L-serine Hydrate (CAS 204191-40-2)
- 1-Methyl-7-(trifluoromethyl)-1H-indazole-3-carboxylic acid (CAS 1956318-35-6)
- 4,4,5,5-Tetramethyl-2-(8-phenylphenanthren-2-yl)-1,3,2-dioxaborolane (CAS CATO-CIM-105129)
- 3-Chloro-5-(trifluoromethyl)isonicotinaldehyde (CAS 1256787-48-0)
- 3-Methyl-n1-(oxan-4-yl)benzene-1,4-diamine (CAS 1153227-88-3)
- N~1~,N~2~,2-trimethylalaninamide hydrochloride (CAS 1820608-90-9)
- 2-(4-tert-Butylphenyl)-6-methylquinoline-4-carboxylic acid (CAS 438219-50-2)
- 8-Chloro-4-hydroxy-6-methylquinoline-3-carboxylic acid (CAS 927800-99-5)
- 3-Benzoyl-2,6-diphenyl-4H-pyran-4-one (CAS 1972603-35-2)
- Semaglutide Impurity 190 (CAS CATO-C4X-2226190)
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