3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene CAS 128454-94-4

Purity 97%+In StockPharmaceutical Standards
CAS No.128454-94-4
Molecular FormulaC8H2BrF13
Molecular Weight424.98 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene CAS 128454-94-4 chemical structure

Description

The occurrence of 3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene is closely related to fluorine/bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene (CAS 128454-94-4), molecular formula C8H2BrF13 and molecular weight 424.98 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C8H2BrF13, 3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene contains fluorine/bromine substitution; these features give the compound characteristic molecular-ion distribution patterns in mass spectrometry. The molecular weight of 424.98 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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.

CATO manufactures 3,3-Bis(trifluoromethyl)-1-bromo-4,4,5,5,6,6,6-heptafluorohex-1-ene 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 FormulaC8H2BrF13
Molecular Weight424.98 g/mol
Purity97%+
StorageStore at room temperature
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityStable under recommended storage conditions
Degree of Unsaturation (DBE)1.0
CAS Registry Year (est.)1993
Halogen ContentF/Br-containing

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