CAS 1208077-37-5

1-Methyl-2-(1-methylethoxy)-3-nitrobenzene

Description:

1-Methyl-2-(1-methylethoxy)-3-nitrobenzene, identified by its CAS number 1208077-37-5, is an organic compound characterized by a nitro group (-NO2) and an ether functional group within its structure. This compound features a benzene ring substituted with a methyl group and a 1-methylethoxy group, which contributes to its hydrophobic properties. The presence of the nitro group indicates potential reactivity, particularly in electrophilic aromatic substitution reactions. The molecular structure suggests that it may exhibit moderate polarity due to the nitro group, while the ether moiety can influence solubility in organic solvents. Additionally, compounds with similar structures often display interesting physical properties, such as varying boiling and melting points, depending on the specific arrangement of substituents. Safety and handling precautions are essential, as nitro compounds can be sensitive to heat and shock, and may pose environmental hazards. Overall, 1-Methyl-2-(1-methylethoxy)-3-nitrobenzene is a compound of interest in organic synthesis and materials science.

Formula: C₁₀H₁₃NO₃

InChI: InChI=1S/C10H13NO3/c1-7(2)14-10-8(3)5-4-6-9(10)11(12)13/h4-7H,1-3H3

InChI key: InChIKey=XIOGUIDOKBSFHU-UHFFFAOYSA-N

SMILES: O(C(C)C)C1=C(N(=O)=O)C=CC=C1C

Synonyms:

• 2-Isopropoxy-3-nitrotoluene
• Benzene, 1-methyl-2-(1-methylethoxy)-3-nitro-
• 1-Methyl-2-(1-methylethoxy)-3-nitrobenzene
• 2-Isopropoxy-1-methyl-3-nitrobenzene