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CAS 351002-91-0

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1-(Bromomethyl)-4-ethynylbenzene

Description:
1-(Bromomethyl)-4-ethynylbenzene, with the CAS number 351002-91-0, is an organic compound characterized by the presence of both a bromomethyl group and an ethynyl group attached to a benzene ring. This compound features a bromine atom, which enhances its reactivity, particularly in nucleophilic substitution reactions. The ethynyl group, a terminal alkyne, contributes to its potential for further chemical transformations, such as coupling reactions, making it valuable in synthetic organic chemistry. The compound is typically a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. Its molecular structure allows for various applications, including in the synthesis of more complex organic molecules and materials. Additionally, the presence of both bromine and the ethynyl group suggests potential uses in pharmaceuticals, agrochemicals, and advanced materials. As with many organic compounds, handling should be done with care, considering safety data and potential hazards associated with brominated compounds.
Formula:C9H7Br
InChI:InChI=1S/C9H7Br/c1-2-8-3-5-9(7-10)6-4-8/h1,3-6H,7H2
InChI key:InChIKey=VLEIHGWNFJPIPO-UHFFFAOYSA-N
SMILES:C(Br)C1=CC=C(C#C)C=C1
Synonyms:
  • 1-(Bromomethyl)-4-ethynylbenzene
  • 4-Ethynylbenzyl Bromide
  • Benzene, 1-(bromomethyl)-4-ethynyl-
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