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CAS 100058-55-7

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Benzoic acid, 2-(2-methylpropyl)-

Description:
Benzoic acid, 2-(2-methylpropyl)-, also known as 2-isobutylbenzoic acid, is an aromatic carboxylic acid characterized by the presence of a benzoic acid moiety with an isobutyl group attached to the second carbon of the benzene ring. This compound typically appears as a white crystalline solid and is soluble in organic solvents while exhibiting limited solubility in water. Its molecular structure contributes to its properties, including moderate acidity due to the carboxylic acid functional group, which can participate in hydrogen bonding. The presence of the isobutyl group influences its hydrophobic characteristics and can affect its reactivity and interactions with other substances. Benzoic acid derivatives, including this compound, are often utilized in various applications, such as in the synthesis of pharmaceuticals, fragrances, and as intermediates in organic chemistry. Safety data indicates that, like many organic acids, it should be handled with care to avoid irritation to skin and eyes.
Formula:C11H14O2
InChI:InChI=1S/C11H14O2/c1-8(2)7-9-5-3-4-6-10(9)11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13)
InChI key:PSHADDQTSCEAHY-UHFFFAOYSA-N
SMILES:CC(C)CC1=CC=CC=C1C(=O)O
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