(E)-4,4,4-Trifluorobut-2-enenitrile CAS 84476-96-0
| CAS No. | 84476-96-0 |
| Molecular Formula | C4H2F3N |
| Molecular Weight | 121.06 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 121.06 g/mol gives (E)-4,4,4-Trifluorobut-2-enenitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies (E)-4,4,4-Trifluorobut-2-enenitrile (CAS 84476-96-0), a certified reference material (molecular formula C4H2F3N, MW 121.06 g/mol) for analytical method development and quality control.
Structurally, (E)-4,4,4-Trifluorobut-2-enenitrile (C4H2F3N) contains a nitrile group, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 3.0, corresponding to approximately 3 ring(s) or double-bond equivalent(s). With a molecular weight of 121.06 g/mol, it falls into the low-molecular-weight range. 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.
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 | C4H2F3N |
| Molecular Weight | 121.06 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 | 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.) | 1981 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related E Standards
- 4,4,4-Trifluorobut-2-ynal (CAS 99048-75-6)
- 4,4,4-trifluorobut-2-yn-1-ol (CAS 113439-92-2)
- 1,1,1-Trifluorobut-3-yn-2-ol (CAS 1592412-29-7)
- 4,4,4-trifluorobut-2-enal (CAS 406-88-2)
- (S)-1,1,1-Trifluorobut-3-en-2-amine (CAS 1301299-48-8)
- 1,1,1-Trifluorobut-3-en-2-amine (CAS 632344-07-1)
- (Z)-4,4,4-Trifluorobut-2-en-1-ol (CAS 83706-98-3)
- 3,4,4-Trifluorobut-3-en-1-ol (CAS 97168-13-3)
Recommended Standards
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- 3-(Cyclohex-2-en-1-yl)-4-hydroxy-1-methylquinolin-2(1H)-one (CAS 211686-40-7)
- 4-(4’-Methyl-2,2’-bipyridin-4-yl)butan-2-ol (CAS 870078-13-0)
- 5-Butyl-4-chloro-2,3-dihydrofuran (CAS 50596-95-7)
- 2-Oxabicyclo[3.1.0]Hexan-6-amine (CAS 1708160-40-0)
- Ethyl 3-chloro-2-methylpropanoate (CAS 922-29-2)
- 2-((5,7-Dibromobenzo[c][1,2,5]thiadiazol-4-yl)oxy)acetic acid (CAS 91982-81-9)
- 4-[(4-Iodophenoxy)methyl]-1,2-dimethoxybenzene (CAS 1283383-50-5)
- Tirzepatide Impurity 13 (CAS CATO-C4X-324013)
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