2-Tert-Butyl-4-methoxyphenol

Synonyms: 2-tert-Butyl-4-methoxyphenol,"3-tert-Butyl-4-hydroxyanisole", "4-Hydroxy-3-tert-butylanisole", "3-BHA", "2-(tert-butyl)-4-methoxyphenol", "4-Methoxy-2-tert-butylphenol", "3-T-BUTYL-4-HYDROXYANISOLE", "Phenol, 2-(1,1-dimethylethyl)-4-methoxy-", "2-(1,1-dimethylethyl)-4-methoxyphenol", "Phenol, 2-tert-butyl-4-methoxy-", "Phenol, (1,1-dimethylethyl)-4-methoxy-", "2-Butyl-4-hydroxyanisole", "Butylated hydroxyanisole I (D)", "2(3)-tert-Butyl-4-methoxyphenol", "2(3)-tert-Butyl-4-hydroxyanisole"

Source: 2-tert-butyl-4-methoxyphenol, is a commonly used antioxidant. This compound is commonly added to foods, gasoline, oils, rubber, and other products to react with and thereby neutralize the free radicals that would otherwise damage the products.

Identifiers:

IUPAC Name: 2-tert-butyl-4-methoxyphenol
CAS Number: 121-00-6
PubChem ID: 8456
InChiKey: MRBKEAMVRSLQPH-UHFFFAOYSA-N
Canonical SMILES: CC(C)(C)C1=C(C=CC(=C1)OC)O

Structural Properties:

Molecular Formula: C₁₁H₁₆O₂
Molecular Weight: 180,240

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 2
Number of atoms different from hydrogen: 13

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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