CAS 898766-61-5

3-Methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid

Description:

3-Methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid, with the CAS number 898766-61-5, is a chemical compound that belongs to the class of substituted benzenes and is characterized by its unique functional groups. This compound features a methoxy group (-OCH3) and a γ-oxobutanoic acid moiety, which contributes to its potential biological activity. The presence of the α,α-dimethyl group indicates steric hindrance, which can influence the compound's reactivity and interaction with biological targets. Typically, such compounds may exhibit properties like moderate solubility in organic solvents and varying degrees of polarity, depending on the substituents. The methoxy group can enhance lipophilicity, potentially affecting the compound's pharmacokinetics. Additionally, the presence of the carboxylic acid functional group (-COOH) suggests that it can participate in acid-base reactions and may exhibit acidic properties. Overall, the structural features of 3-Methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid suggest it could have applications in medicinal chemistry or as a synthetic intermediate in organic synthesis.

Formula: C₁₃H₁₆O₄

InChI: InChI=1/C13H16O4/c1-13(2,12(15)16)8-11(14)9-5-4-6-10(7-9)17-3/h4-7H,8H2,1-3H3,(H,15,16)

InChI key: InChIKey=HZTLYJVRGLYRHJ-UHFFFAOYSA-N

SMILES: C(CC(C(O)=O)(C)C)(=O)C1=CC(OC)=CC=C1

Synonyms:

• Benzenebutanoic acid, 3-methoxy-α,α-dimethyl-γ-oxo-
• 3-Methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid
• 2,2-DIMETHYL-4-(3-METHOXYPHENYL)-4-OXOBUTYRIC ACID

2,2-Dimethyl-4-(3-methoxyphenyl)-4-oxobutyric acid

CAS: 898766-61-5

Formula: C₁₃H₁₆O₄

Purity: 97.0%

Molecular weight: 236.267

Ref: 10-F207221