(2S)-4,4,4-Trifluoro-3-oxo-2-phenylbutanenitrile CAS 175205-70-6
| CAS No. | 175205-70-6 |
| Molecular Formula | C10H6F3NO |
| Molecular Weight | 213.16 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 (2S)-4,4,4-Trifluoro-3-oxo-2-phenylbutanenitrile.
(2S)-4,4,4-Trifluoro-3-oxo-2-phenylbutanenitrile (CAS 175205-70-6), molecular formula C10H6F3NO and molecular weight 213.16 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, (2S)-4,4,4-Trifluoro-3-oxo-2-phenylbutanenitrile (C10H6F3NO) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 213.16 g/mol, it falls into the medium-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.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures (2S)-4,4,4-Trifluoro-3-oxo-2-phenylbutanenitrile under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C10H6F3NO |
| Molecular Weight | 213.16 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2007 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related S Standards
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Recommended Standards
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- Methyl 4-bromo-2-cyano-3-formylbenzoate (CAS 1805592-47-5)
- 2-Chloro-4-thiomorpholinomethyl benzophenone (CAS 898782-90-6)
- 1-(7-(2-Chlorophenyl)-1,4-thiazepan-4-yl)-3-methylbut-2-en-1-one (CAS 1798638-31-9)
- 5-fluoro-1-methyl-indole (CAS 116176-92-2)
- Trichloroacetonitrile (CAS 545-06-2)
- 2-Benzyl-4-bromopyridazin-3(2h)-one (CAS 1824271-93-3)
- 4-((4-Ethoxy-3-methoxybenzylidene)amino)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5(4H)-thione (CAS 680998-73-6)
- 4-((1,1-Dioxidothietan-3-yl)amino)-4-oxobut-2-enoic acid (CAS 1868036-91-2)
- 2-(2-(Pentyloxy)benzylidene)-6-phenyl-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione (CAS 617695-14-4)
- Calcium-Like Peptide 3 (CAS 261969-05-5)
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