CAS 20185-55-1

methyl 4-(propan-2-yl)benzoate

Description:

Methyl 4-(propan-2-yl)benzoate, also known as isobutyl p-toluate, is an organic compound characterized by its ester functional group. It is derived from the reaction of p-toluic acid and methanol, resulting in a structure that features a methyl ester group attached to a para-substituted aromatic ring. This compound typically appears as a colorless to pale yellow liquid with a pleasant, fruity odor, making it useful in the fragrance and flavoring industries. It is moderately soluble in organic solvents but has limited solubility in water due to its hydrophobic aromatic structure. Methyl 4-(propan-2-yl)benzoate is stable under normal conditions but may undergo hydrolysis in the presence of strong acids or bases. Its applications extend beyond fragrances, as it can also serve as an intermediate in organic synthesis. Safety data indicates that it should be handled with care, as it may cause irritation upon contact with skin or eyes and should be used in well-ventilated areas to avoid inhalation of vapors.

Formula: C₁₁H₁₄O₂

InChI: InChI=1/C11H14O2/c1-8(2)9-4-6-10(7-5-9)11(12)13-3/h4-8H,1-3H3

SMILES: CC(C)c1ccc(cc1)C(=O)OC

Synonyms:

• Benzoic acid, 4- (1-methylethyl)-, methyl ester
• Benzoic acid, p-isopropyl-, methyl ester
• Methyl 4-isopropylbenzoate
• Methyl cumate
• Methyl p-isopropylbenzoate

Methyl 4-Isopropylbenzoate

CAS: 20185-55-1

Formula: C₁₁H₁₄O₂

Purity: >98.0%(GC)

Color and Shape: Colorless to Light yellow clear liquid

Molecular weight: 178.23

Ref: 3B-M3307

Methyl 4-isopropylbenzoate

CAS: 20185-55-1

Formula: C₁₁H₁₄O₂

Purity: 95%

Color and Shape: Liquid

Molecular weight: 178.2277

Ref: IN-DA00BDMT

Methyl 4-isopropylbenzoate

CAS: 20185-55-1

Methyl 4-isopropylbenzoate

Purity: 98%

Molecular weight: 178.23g/mol

Ref: 54-OR911559

Methyl 4-iso-propylbenzoate

CAS: 20185-55-1

Formula: C₁₁H₁₄O₂

Purity: 95%

Color and Shape: No data available.

Molecular weight: 178.231

Ref: 10-F395251

Methyl 4-isopropylbenzoate

CAS: 20185-55-1

Methyl 4-isopropylbenzoate is a reactive chemical that can be used to modify the properties of other compounds. Reaction with light causes it to emit light in the range of 300-400 nm, which makes it a useful functionalizing agent. Methyl 4-isopropylbenzoate is an irritant and can cause allergic reactions in some people. It is also a strong oxidizer and reacts with chlorine, copper salt, and metal ions. Methyl 4-isopropylbenzoate is sensitive to acid, and can be used as an acid catalyst in synthesis reactions involving difluoride or terephthalic acid. The molecular weight of methyl 4-isopropylbenzoate is low enough that it can be used in diagnostic assays for determining levels of certain compounds such as terephthalic acid or difluoride. The melting point for this compound is 38°C.

Formula: C₁₁H₁₄O₂

Purity: Min. 95%

Molecular weight: 178.23 g/mol

Ref: 3D-VAA18555