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CAS 37621-57-1

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1-bromo-2,3,4,5,6,7,8-heptadeuterio-naphthalene

Description:
1-Bromo-2,3,4,5,6,7,8-heptadeuterio-naphthalene is a deuterated derivative of naphthalene, where seven hydrogen atoms are replaced by deuterium, a stable isotope of hydrogen. This compound features a naphthalene backbone, which consists of two fused aromatic rings, contributing to its planar structure and significant π-electron delocalization. The presence of the bromine atom introduces a polar functional group, which can influence the compound's reactivity and solubility in various solvents. The deuteration enhances its utility in spectroscopic studies, particularly in nuclear magnetic resonance (NMR) spectroscopy, as it provides distinct signals due to the presence of deuterium. This compound is typically used in research applications, including studies of reaction mechanisms and dynamics in organic chemistry. Its physical properties, such as melting point and boiling point, may differ from those of non-deuterated naphthalene due to the isotopic substitution, which can affect vibrational frequencies and intermolecular interactions. Overall, 1-bromo-2,3,4,5,6,7,8-heptadeuterio-naphthalene serves as a valuable tool in both synthetic and analytical chemistry.
Formula:C10D7Br
InChI:InChI=1/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H/i1D,2D,3D,4D,5D,6D,7D
SMILES:c1(c(c(c2c(c1[2H])c(c(c(c2Br)[2H])[2H])[2H])[2H])[2H])[2H]
Synonyms:
  • 1-Bromo(< sup> 2< /sup> H< sub> 7< /sub> )naphthalene
  • Naphthalene-1,2,3,4,5,6,7-D< Sub> 7< /Sub> , 8-Bromo-
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