CAS 1040692-71-4

4-(3-Methylbutoxy)-N-(1-methylpropyl)benzenemethanamine

Description:

4-(3-Methylbutoxy)-N-(1-methylpropyl)benzenemethanamine, identified by its CAS number 1040692-71-4, is a chemical compound that belongs to the class of amines. This substance features a benzene ring substituted with a methanamine group and an alkoxy side chain, specifically a 3-methylbutoxy group. Its structure suggests potential hydrophobic characteristics due to the presence of the long alkyl chain, which may influence its solubility in organic solvents rather than in water. The compound may exhibit biological activity, as many amines are known for their roles in pharmacology and biochemistry. Its molecular interactions could be significant in various applications, including medicinal chemistry and material science. However, specific data regarding its toxicity, stability, and reactivity would require further investigation through experimental studies or literature reviews. As with any chemical substance, proper handling and safety protocols should be observed, especially in laboratory settings.

Formula: C₁₆H₂₇NO

InChI: InChI=1S/C16H27NO/c1-5-14(4)17-12-15-6-8-16(9-7-15)18-11-10-13(2)3/h6-9,13-14,17H,5,10-12H2,1-4H3

InChI key: InChIKey=XTHNBNOVPCHQDR-UHFFFAOYSA-N

SMILES: C(NC(CC)C)C1=CC=C(OCCC(C)C)C=C1

Synonyms:

• 4-(3-Methylbutoxy)-N-(1-methylpropyl)benzenemethanamine
• Benzenemethanamine, 4-(3-methylbutoxy)-N-(1-methylpropyl)-