1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene CAS 99696-01-2
| CAS No. | 99696-01-2 |
| Molecular Formula | C9H6F3NO2 |
| Molecular Weight | 217.14 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene (CAS 99696-01-2), a certified reference material (molecular formula C9H6F3NO2, MW 217.14 g/mol) for analytical method development and quality control.
Structurally, 1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene (C9H6F3NO2) 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 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 217.14 g/mol, it falls into the medium-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.
As a certified reference material (CRM), 1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene 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 | C9H6F3NO2 |
| Molecular Weight | 217.14 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 methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related Nitrovinyl Standards
- (E)-1-(2-Nitrovinyl)-4-(trifluoromethyl)benzene (CAS 93628-97-8)
- 1-[2-Nitrovinyl]-2-(trifluoromethyl)benzene (CAS 53960-62-6)
- (E)-1-(2-Nitrovinyl)-3-(Trifluoromethyl)Benzene (CAS 115665-96-8)
- (E)-4-(2-nitrovinyl)-1,1'-biphenyl (CAS 263551-29-7)
- (E)-6-(2-nitrovinyl)-2,3-dihydrobenzo[b][1,4]dioxine (CAS 10554-65-1)
- 2-Methyl-3-(2-nitrovinyl)-1H-indole (CAS 2826-91-7)
- (E)-3-(2-Nitrovinyl)quinoline (CAS 701913-51-1)
- (E)-1-(2-Nitrovinyl)naphthalene (CAS 37630-26-5)
Recommended Standards
- 1-(1,3-Benzoxazol-2-yl)-2,2,2-trifluoroethan-1-ol (CAS 924713-08-6)
- 1-(3-Trifluoromethylphenyl)-2-nitroethylene (CAS 62248-94-6)
- (E)-3-(6-(trifluoromethyl)pyridin-3-yl)acrylic acid (CAS 944805-93-0)
- 1-(4,4-Difluoro-1-piperidinyl)-2,2,2-trifluoroethanone (CAS 65220-85-1)
- 5-(6-((4-Bromobenzyl)thio)pyridazin-3-yl)-2-(4-methoxyphenyl)-4-methylthiazole (CAS 954661-79-1)
- Methyl 3-(4-fluorophenyl)isonicotinate (CAS 873458-37-8)
- Tert-butyl indoline-2-carboxylate (CAS 1218501-71-3)
- (1-Isobutyl-1H-imidazol-5-yl)methanamine (CAS 1177324-54-7)
- 2-Cyclopropylcyclopropane-1-carbaldehyde (CAS 1545048-97-2)
- 3-Fluoro-N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)isonicotinamide (CAS 903522-31-6)
- 5-Bromo-3-fluoro-N1-methylbenzene-1,2-diamine (CAS 1396503-78-8)
- 2-(aminomethyl)imidazo[1,2-a]pyridine-6-carbonitrile (CAS 1020034-14-3)
- 2-Acetate-6-[(phenylmethoxy)methyl]-1,4-dioxane-2-methanol (CAS 338458-98-3)
- Eosinophilotactic Peptide (CAS 61756-28-3)
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