CAS 7048-42-2

2-Methoxy-5-methylbenzeneacetonitrile

Description:

2-Methoxy-5-methylbenzeneacetonitrile, also known by its CAS number 7048-42-2, is an organic compound characterized by the presence of a methoxy group and a nitrile functional group attached to a benzene ring. This compound features a methyl group at the 5-position of the benzene ring, contributing to its overall hydrophobic character. It is typically a colorless to pale yellow liquid with a distinctive aromatic odor. The presence of the nitrile group imparts notable polarity, which can influence its solubility in various solvents. This compound is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its reactivity is primarily dictated by the functional groups present, allowing for various chemical transformations. Safety data sheets should be consulted for handling and storage guidelines, as it may pose health risks if inhaled or ingested. Overall, 2-Methoxy-5-methylbenzeneacetonitrile is a versatile compound with applications in chemical research and industry.

Formula: C₁₀H₁₁NO

InChI: InChI=1/C10H11NO/c1-8-3-4-10(12-2)9(7-8)5-6-11/h3-4,7H,5H2,1-2H3

InChI key: InChIKey=PNSVXFHBPNXSFB-UHFFFAOYSA-N

SMILES: C(C#N)C1=C(OC)C=CC(C)=C1

Synonyms:

• Acetonitrile, (6-methoxy-m-tolyl)-
• 2-(2-Methoxy-5-methylphenyl)acetonitrile
• (2-Methoxy-5-methylphenyl)-acetonitrile
• 2-Methoxy-5-methylbenzeneacetonitrile
• Benzeneacetonitrile, 2-methoxy-5-methyl-

2-(2-Methoxy-5-methylphenyl)acetonitrile

CAS: 7048-42-2

Versatile small molecule scaffold

Formula: C₁₀H₁₁NO

Purity: Min. 95%

Molecular weight: 161.2 g/mol

Ref: 3D-HAA04842