2-(4-Nitro-2-(trifluoromethyl)phenyl)acetonitrile CAS 1067192-61-3

Purity 97%+In StockPharmaceutical Standards
CAS No.1067192-61-3
Molecular FormulaC9H5F3N2O2
Molecular Weight230.14 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(4-Nitro-2-(trifluoromethyl)phenyl)acetonitrile CAS 1067192-61-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 230.14 g/mol gives 2-(4-Nitro-2-(trifluoromethyl)phenyl)acetonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

2-(4-Nitro-2-(trifluoromethyl)phenyl)acetonitrile (CAS 1067192-61-3) is a high-purity analytical reference standard with the molecular formula C9H5F3N2O2 and a molecular weight of 230.14 g/mol.

Structurally, 2-(4-Nitro-2-(trifluoromethyl)phenyl)acetonitrile (C9H5F3N2O2) 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 230.14 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), 2-(4-Nitro-2-(trifluoromethyl)phenyl)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 FormulaC9H5F3N2O2
Molecular Weight230.14 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentF-containing
Nitrogen Atoms2

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