Description

1-Bromo-2-(bromodifluoromethyl)cyclohexane (CAS No. 14737-09-8) is a highly specialized brominated and fluorinated cyclohexane derivative with the molecular formula C₇H₁₀Br₂F₂. This compound is characterized by its unique structural features, including a bromine substituent at the 1-position and a bromodifluoromethyl group at the 2-position of the cyclohexane ring. It is a valuable intermediate in organic synthesis, particularly in the preparation of fluorinated compounds and as a building block for pharmaceuticals, agrochemicals, and advanced materials. The compound is supplied as a high-purity liquid, ensuring consistency and reliability for research and industrial applications. Proper handling and storage under inert conditions are recommended due to its reactive nature.

Properties

• CAS Number: 14737-09-8
• Complexity: 138
• IUPAC Name: 1-bromo-2-[bromo(difluoro)methyl]cyclohexane
• InChI: InChI=1S/C7H10Br2F2/c8-6-4-2-1-3-5(6)7(9,10)11/h5-6H,1-4H2
• InChI Key: MWCUYVZBWZWWKO-UHFFFAOYSA-N
• Exact Mass: 291.90968
• Molecular Formula: C7H10Br2F2
• Molecular Weight: 291.96
• SMILES: C1CCC(C(C1)C(F)(F)Br)Br
• Monoisotopic Mass: 289.91173
• Synonyms: 1-Bromo-2-(bromodifluoromethyl)cyclohexane, 14737-09-8, 1-bromo-2-(bromodifluoromethyl)-cyclohexane, 117711-58-7, 1-bromo-2-[bromo(difluoro)methyl]cyclohexane, MFCD00077459, Cyclohexane,1-bromo-2-(bromodifluoromethyl)-, DTXSID80933105, BCP14295, AKOS008901436, DB-042880, 1-Bromo-2-(bromo-difluoro-methyl)-cyclohexane

Application

1-Bromo-2-(bromodifluoromethyl)cyclohexane is primarily used as a versatile intermediate in organic synthesis, particularly for introducing fluorinated and brominated functionalities into target molecules. It finds applications in the development of pharmaceuticals, agrochemicals, and specialty materials where fluorinated compounds are desired for their unique properties. Researchers also utilize this compound in the study of reaction mechanisms involving halogenated cyclohexanes.

Safety and Hazards

GHS Hazard Statements

• H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

• P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

• Skin Irrit. 2 (100%)
• Eye Irrit. 2 (100%)
• STOT SE 3 (100%)

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