4-Chlorobenzonitrile-d4

Product Name 4-Chlorobenzonitrile-d4
CAT No. CS-C-00460
CAS No. 1219794-82-7
Category Stable Isotopes
Stock Enquire
Mol. Wt. Not Available
Mol. For. Not Available
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Canonical Smiles C1=CC(=CC=C1C#N)Cl
InchIKey GJNGXPDXRVXSEH-RHQRLBAQSA-N
Inchl InChI=1S/C7H4ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H/i1D,2D,3D,4D
IUPAC 4-chloro-2,3,5,6-tetradeuteriobenzonitrile
Controlled No
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4-Chlorobenzonitrile-d4 is a deuterated form of 4-Chlorobenzonitrile, a white crystalline powder with a molecular formula of C7D4ClN. It is a stable isotope labeled compound used in various chemical research applications. 4-Chlorobenzonitrile-d4 is commonly used as an internal standard in mass spectrometry and nuclear magnetic resonance (NMR) spectroscopy analyses. It is also used as a reference material for calibration purposes and quality control in pharmaceutical and chemical manufacturing industries. The compound has a boiling point of 246.9°C and a melting point of 56-59°C. It is highly stable under normal conditions, but can undergo hydrolysis and oxidation reactions when exposed to strong acids or oxidizing agents. In terms of safety, 4-Chlorobenzonitrile-d4 should be handled with caution as it is a potential irritant and toxic substance. Proper protective equipment, such as gloves and eye protection, should be worn when handling the compound. Overall, 4-Chlorobenzonitrile-d4 is a useful tool for chemical research and analysis, particularly in the fields of mass spectrometry and NMR spectroscopy. Its stable isotopic labeling provides accurate and precise results in various applications.

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