CAS 57414-78-5

Benzenamine, 2-methyl-3-(methyl-d3)-

Description:

Benzenamine, 2-methyl-3-(methyl-d3)-, also known as 2-methyl-3-(methyl-d3)aniline, is an aromatic amine characterized by its structure, which includes a benzene ring substituted with an amino group and two methyl groups, one of which is deuterated (methyl-d3). This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in organic solvents and exhibits moderate polarity due to the presence of the amino group. The deuterated methyl group allows for unique applications in isotopic labeling, making it useful in various fields such as medicinal chemistry and analytical studies. The presence of the amino group contributes to its basicity and potential reactivity in electrophilic aromatic substitution reactions. Safety considerations include handling it with care due to potential toxicity associated with aromatic amines. Overall, this compound serves as an important intermediate in organic synthesis and research applications.

Formula: C₈H₈D₃N

InChI: InChI=1S/C8H11N/c1-6-4-3-5-8(9)7(6)2/h3-5H,9H2,1-2H3/i1D3

InChI key: InChIKey=VVAKEQGKZNKUSU-FIBGUPNXSA-N

SMILES: CC1=C(C([2H])([2H])[2H])C=CC=C1N

Synonyms:

• 2-Methyl-3-trideuteriomethyl-aniline
• Benzenamine, 2-methyl-3-(methyl-d3)-
• 2-Methyl-3-(trideuteriomethyl)aniline

2,3-Dimethylaniline-d3

Controlled Product

CAS: 57414-78-5

Stability Air sensitive
Applications Reagent used in the preparation of labelled non-steroidal anti-inflammatory drugs, dyes and pesticides.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Cauchon, D., et al.: J. Appl. Toxicol., 17, 397 (1997),

Formula: C₈₂H₃H₈N

Color and Shape: Neat

Molecular weight: 124.20

Ref: TR-D462192