1,3-Dichloro-5-fluoro-2-(trifluoromethyl)benzene CAS 1807179-76-5

Purity 97%+In StockPharmaceutical Standards
CAS No.1807179-76-5
Molecular FormulaC7H2Cl2F4
Molecular Weight232.99 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1,3-Dichloro-5-fluoro-2-(trifluoromethyl)benzene CAS 1807179-76-5 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 232.99 g/mol gives 1,3-Dichloro-5-fluoro-2-(trifluoromethyl)benzene distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

1,3-Dichloro-5-fluoro-2-(trifluoromethyl)benzene (CAS 1807179-76-5), molecular formula C7H2Cl2F4 and molecular weight 232.99 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 1,3-Dichloro-5-fluoro-2-(trifluoromethyl)benzene (C7H2Cl2F4) contains fluorine/chlorine substitution, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 4.0, corresponding to approximately 4 ring(s) or double-bond equivalent(s). With a molecular weight of 232.99 g/mol, it falls into the medium-molecular-weight range. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

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 FormulaC7H2Cl2F4
Molecular Weight232.99 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1995
Halogen ContentF/Cl-containing

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