CAS 68239-23-6

3-Chloro-6-nitrobenzene-1,2,4,5-d4

Description:

3-Chloro-6-nitrobenzene-1,2,4,5-d4 is a deuterated derivative of 3-chloro-6-nitrobenzene, where the hydrogen atoms at positions 1, 2, 4, and 5 of the benzene ring are replaced with deuterium isotopes. This compound is characterized by its aromatic structure, which includes a chlorine atom and a nitro group (-NO2) as substituents on the benzene ring. The presence of the nitro group typically imparts strong electron-withdrawing properties, influencing the compound's reactivity and polarity. The deuteration enhances its utility in various applications, particularly in NMR spectroscopy, where it can serve as a tracer or internal standard due to the distinct spectral characteristics of deuterated compounds. Additionally, the chlorine atom can participate in nucleophilic substitution reactions, making this compound relevant in synthetic organic chemistry. Overall, 3-Chloro-6-nitrobenzene-1,2,4,5-d4 is a valuable compound for research in both chemical synthesis and analytical chemistry.

Formula: C₆ClD₄NO₂

InChI: InChI=1/C6H4ClNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H/i1D,2D,3D,4D

InChI key: InChIKey=CZGCEKJOLUNIFY-RHQRLBAQSA-N

SMILES: N(=O)(=O)C1=C(C(=C(Cl)C(=C1[2H])[2H])[2H])[2H]

Synonyms:

• 1-Chloro-2,3,5,6-tetradeuterio-4-nitrobenzene
• 1-chloro-4-nitro(~2~H_4_)benzene
• 3-Chloro-6-nitrobenzene-1,2,4,5-d₄
• 4-Chloro-2,3,5,6-tetradeutero-1-nitrobenzene
• Benzene-1,2,4,5-d4, 3-chloro-6-nitro-
• Benzene-1,2,4,5-d₄, 3-chloro-6-nitro-
• p-Chloronitrobenzene-d₄
• 3-Chloro-6-nitrobenzene-1,2,4,5-d4
• 1-Chloro-4-nitro(2H4)benzene
• p-Chloronitrobenzene-d4
• 3-Chloro-6-nitro(1,2,4,5-2H4)benzene

4-Chloronitrobenzene-d4

CAS: 68239-23-6

4-Chloronitrobenzene-d4

Formula: C₆ClD₄NO₂

Purity: 98%

Molecular weight: 161.58

Ref: 54-DE2564

4-Chloronitrobenzene-D4

CAS: 68239-23-6

4-Chloronitrobenzene-D4 is the deuterium labeled 4-Chloronitrobenzene. 4-Nitrochlorobenzene is a common intermediate in the production of a number of industrially useful compounds, including antioxidants commonly found in rubber.

Formula: C₆H₄ClNO₂

Molecular weight: 161.58

Ref: TM-TMIR-0054

4-Chloronitrobenzene-d4

CAS: 100-00-5, 68239-23-6

Formula: ClC₆D₄NO₂

Purity: 98 atom % D

Color and Shape: Yellow-Green Solid

Molecular weight: 161.01816

Ref: 3U-D5469

4-Chloronitrobenzene-d4

Controlled Product

CAS: 68239-23-6

Applications Isotope labelled 4-Chloronitrobenzene is a common intermediate in the production of a number of industrially useful compounds.
References Guo, H.C., et al.: J. Am. Chem. Soc., 131, 6318 (2009); Miura, Y., et al.: J. Org. Chem., 59, 3294 (1994);

Formula: C₆D₄ClNO₂

Color and Shape: Neat

Molecular weight: 161.58

Ref: TR-C373912