N-Benzoyl-2-methylalanine

CAS: 57224-51-8

Ref. 3D-FB122992

Product Information

• Name: N-Benzoyl-2-methylalanine
• Synonyms: alanine, N-benzoyl-2-methyl-, 2-Benzamido-2-methyl-propanoic acid, 2-Benzamido-2-methylpropanoic acid, 2-Benzoylamino-2-methyl-propionic acid, 2-Methyl-2-(phenylformamido)propanoic acid, N-Benzoyl-2-aminoisobutyric acid, NSC 85157, alanine, N-benzoyl-2-methyl-

Description

N-Benzoyl-2-methylalanine is a metabolite of benzoyl peroxide. It is found in human urine, and has been detected in urine samples from industrial workers. N-Benzoyl-2-methylalanine is an acid conjugate, which means it can be converted back to the parent compound, benzoyl peroxide. This metabolite has been shown to be present in the urine of animals and humans. The metabolic pathway for this compound is not well understood, but it may undergo oxidation to form metabolites such as the n-oxide or carboxylate.

• Brand: Biosynth

Chemical properties

• Molecular weight: 207.23 g/mol
• Formula: C₁₁H₁₃NO₃
• Purity: Min. 95%
• InChI: InChI=1S/C11H13NO3/c1-11(2,10(14)15)12-9(13)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,12,13)(H,14,15)
• InChI key: InChIKey=AXAMLHJXUICVAY-UHFFFAOYSA-N
• SMILES: CC(C)(NC(=O)c1ccccc1)C(=O)O