C8H7N
124.19 g/mol
Pharmaceutical IntermediateDanger
2,2-dideuterio-2-(2,3,4,5,6-pentadeuteriophenyl)acetonitrile
CAS65538-26-3
Category
Pharmaceutical Intermediate
Compound Class
Aromatic
Primary Use
Pharmaceutical Intermediate
This compound is a deuterated derivative of phenylacetonitrile, where all hydrogen atoms on the phenyl ring and the benzylic methylene group are replaced by deuterium. It is primarily used as an intermediate in the synthesis of deuterated pharmaceuticals, leveraging the kinetic isotope effect to improve metabolic stability.
deuterated pharmaceutical intermediateresearch compound for metabolic stability studies
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 65538-26-3
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Safety Reference
Danger
H301Toxic if swallowed
H311Toxic in contact with skin
H330Fatal if inhaled
Identifiers
IUPAC Name
2,2-dideuterio-2-(2,3,4,5,6-pentadeuteriophenyl)acetonitrile
InChIKey
SUSQOBVLVYHIEX-XZJKGWKKSA-N
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C([2H])([2H])C#N)[2H])[2H]
Synonyms (2)
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