CAS 60-44-6

Penthienate bromide

Description:

Penthienate bromide, with the CAS number 60-44-6, is a chemical compound that belongs to the class of organic bromides. It is characterized by its molecular structure, which includes a penthienate anion paired with a bromide cation. This compound is typically used in organic synthesis and may serve as a reagent in various chemical reactions. Penthienate bromide is known for its potential applications in the field of medicinal chemistry and materials science, particularly in the development of new pharmaceuticals or functional materials. The compound is generally stable under standard conditions but may require specific handling and storage protocols to maintain its integrity and prevent degradation. As with many brominated compounds, it is important to consider its reactivity and potential environmental impact, as brominated substances can sometimes pose risks to health and ecosystems. Proper safety measures should be observed when working with this compound, including the use of personal protective equipment and adherence to relevant regulations.

Formula: C₁₈H₃₀NO₃S·Br

InChI: InChI=1S/C18H30NO3S.BrH/c1-4-19(3,5-2)12-13-22-17(20)18(21,15-9-6-7-10-15)16-11-8-14-23-16;/h8,11,14-15,21H,4-7,9-10,12-13H2,1-3H3;1H/q+1;/p-1

InChI key: InChIKey=VWGJUXTWIWCQGL-UHFFFAOYSA-M

SMILES: C(C(OCC[N+](CC)(CC)C)=O)(O)(C1CCCC1)C2=CC=CS2.[Br-]

Synonyms:

• Ethanaminium, 2-[(cyclopentylhydroxy-2-thienylacetyl)oxy]-N,N-diethyl-N-methyl-, bromide
• Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, α-cyclopentyl-2-thiopheneglycolate
• Diethyl(2-hydroxyethyl)methylammonium bromide, α-cyclopentyl-2-thiopheneglycolate
• Ethanaminium, 2-[[2-cyclopentyl-2-hydroxy-2-(2-thienyl)acetyl]oxy]-N,N-diethyl-N-methyl-, bromide (1:1)
• 2-Thiopheneglycolic acid, α-cyclopentyl-, ester with diethyl(2-hydroxyethyl)methylammonium bromide

Penthienate Bromide

CAS: 60-44-6

Color and Shape: Neat

Ref: 61-FOR1598.00