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CAS 3855-82-1

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1,4-Dichlorobenzene-d4

Description:
1,4-Dichlorobenzene-d4, with the CAS number 3855-82-1, is a deuterated form of 1,4-dichlorobenzene, a chlorinated aromatic hydrocarbon. This compound features two chlorine atoms substituted at the 1 and 4 positions of a benzene ring, with four deuterium atoms replacing hydrogen atoms, enhancing its utility in various analytical applications, particularly in nuclear magnetic resonance (NMR) spectroscopy. The presence of deuterium increases the compound's stability and alters its physical properties, such as boiling and melting points, compared to its non-deuterated counterpart. 1,4-Dichlorobenzene-d4 is typically used as a solvent and a reference standard in NMR studies due to its unique spectral characteristics. It is also employed in research involving environmental chemistry and toxicology, as it can serve as a model compound for studying the behavior of chlorinated aromatic compounds in various systems. As with other chlorinated compounds, safety precautions should be observed due to potential health hazards associated with exposure.
Formula:C6Cl2D4
InChI:InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H/i1D,2D,3D,4D
InChI key:InChIKey=OCJBOOLMMGQPQU-RHQRLBAQSA-N
SMILES:ClC1=C(C(=C(Cl)C(=C1[2H])[2H])[2H])[2H]
Synonyms:
  • 1,4-Dichloro-2,3,5,6-tetradeuteriobenzene
  • 1,4-Dichlorobenzene-d<sub>4</sub>
  • 1,4-Dichloroperdeuteriobenzene
  • 1,4-dichloro(~2~H_4_)benzene
  • 3,6-Dichlorobenzene-1,2,4,5-d4
  • 3,6-Dichlorobenzene-1,2,4,5-d<sub>4</sub>
  • Benzene-1,2,4,5-d4, 3,6-dichloro-
  • Benzene-1,2,4,5-d<sub>4</sub>, 3,6-dichloro-
  • Benzene-1,2,4,5-d<sub>4</sub>, dichloro-
  • Tetradeutero-p-dichlorobenzene
  • See more synonyms
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