Description

Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate (CAS: 6386-39-6) is a high-purity phenolic ester compound with the molecular formula C₁₅H₂₂O₃. This specialized chemical is designed for researchers and scientists working in organic synthesis, pharmaceuticals, and material science. Its unique structure, featuring a tert-butyl group and a hydroxy-methylphenyl moiety, makes it a valuable intermediate in the development of antioxidants, stabilizers, and bioactive molecules. The product is rigorously tested for purity and consistency, ensuring reliable performance in sensitive applications. Available in various quantities, it is supplied with comprehensive analytical data (including NMR, HPLC, and MS) to meet stringent laboratory standards.

Properties

• CAS Number: 6386-39-6
• Complexity: 280
• IUPAC Name: methyl 3-(3-tert-butyl-4-hydroxy-5-methyl-phenyl)propanoate
• InChI: InChI=1S/C15H22O3/c1-10-8-11(6-7-13(16)18-5)9-12(14(10)17)15(2,3)4/h8-9,17H,6-7H2,1-5H3
• InChI Key: FQCQJBVYSORVEW-UHFFFAOYSA-N
• Exact Mass: 250.15689456
• Molecular Formula: C15H22O3
• Molecular Weight: 250.33
• SMILES: CC1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OC
• Topological: 46.5
• Monoisotopic Mass: 250.15689456
• Synonyms: Methyl 3-(1,1-dimethylethyl)-4-hydroxy-5-methylbenzenepropanoate, 6386-39-6, methyl 3-(3-tert-butyl-4-hydroxy-5-methylphenyl)propanoate, Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-5-methyl-, methyl ester, methyl 3-(3-(tert-butyl)-4-hydroxy-5-methylphenyl)propanoate, CL7N9V8CHW, Methyl-3-(3-tert.-butyl-4-hydroxy-5-methylphenyl)propionat, UNII-CL7N9V8CHW, SCHEMBL1292189, DTXSID5073371, AKOS015851628, AC-5022, NS00022607, methyl 3-methyl-5-tert-butyl-4-hydroxyhydrocinnamate, Methyl 3-(3-tert-butyl-5-methyl-4-hydroxyphenyl)propionate, METHYL 3-(3-METHYL-5-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONATE

This compound is primarily used as an intermediate in the synthesis of phenolic antioxidants and UV stabilizers for polymers. Researchers leverage its sterically hindered phenol structure to develop novel additives for enhancing material durability. It also finds applications in pharmaceutical research as a precursor for bioactive molecules with potential therapeutic effects. Its stability and reactivity make it suitable for controlled organic transformations in fine chemical synthesis.

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