CAS 67853-03-6

methyl 3-(hydroxymethyl)benzoate

Description:

Methyl 3-(hydroxymethyl)benzoate, with the CAS number 67853-03-6, is an organic compound that belongs to the class of benzoate esters. It features a benzoic acid derivative where a hydroxymethyl group is substituted at the meta position relative to the ester functional group. This compound is typically a colorless to pale yellow liquid or solid, depending on its purity and specific conditions. It is characterized by its pleasant aromatic odor, which is common among many benzoate derivatives. Methyl 3-(hydroxymethyl)benzoate is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic aromatic structure. The presence of both the ester and hydroxymethyl functional groups allows for potential reactivity in various chemical reactions, including esterification and nucleophilic substitution. This compound may find applications in the synthesis of fragrances, pharmaceuticals, or as an intermediate in organic synthesis. As with many organic compounds, proper handling and safety precautions should be observed due to potential irritant properties.

Formula: C₉H₁₀O₃

InChI: InChI=1/C9H10O3/c1-12-9(11)8-4-2-3-7(5-8)6-10/h2-5,10H,6H2,1H3

SMILES: COC(=O)c1cccc(c1)CO

Synonyms:

• 3-Hydroxymethyl-Benzoic Acid Methyl Ester
• Benzoic Acid, 3-(Hydroxymethyl)-, Methyl Ester
• Methyl 3-(hydroxymethyl)benzoate

3-Hydroxymethyl-benzoic acid methyl ester

CAS: 67853-03-6

Formula: C₉H₁₀O₃

Purity: 97%

Color and Shape: Liquid

Molecular weight: 166.1739

Ref: IN-DA006IJ6

Methyl 3-(hydroxymethyl)benzoate

CAS: 67853-03-6

Methyl 3-(hydroxymethyl)benzoate

Purity: 99%

Molecular weight: 166.17g/mol

Ref: 54-OR931154

Methyl 3-(hydroxymethyl)benzoate

CAS: 67853-03-6

Methyl 3-(hydroxymethyl)benzoate is an efficient, selective and scalable formylation agent that can be used to formylate a wide range of alcohols. It has been shown to be an excellent formylating agent for the synthesis of chloral, acetone, and other phenols. This compound is also notably useful in the preparation of anhydrous methyl 3-formylbenzoate which can be used as a precursor for other biologically active compounds. Methyl 3-(hydroxymethyl)benzoate is synthesized by reacting a hydroxymethyl group with benzoyl chloride or benzaldehyde. This reaction occurs at temperatures between -78°C and 20°C, with yields ranging from 70% to 95%.

Formula: C₉H₁₀O₃

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 166.17 g/mol

Ref: 3D-FM67567

Methyl 3-(hydroxymethyl)benzoate

CAS: 67853-03-6

Formula: C₉H₁₀O₃

Purity: 98%

Color and Shape: Liquid

Molecular weight: 166.176

Ref: 10-F319993

Methyl 3-(Hydroxymethyl)Benzoate

Controlled Product

CAS: 67853-03-6

Applications Methyl 3-(Hydroxymethyl)benzoate is used in the synthetic preparation of N-acylhydrazone derivatives as lactate dehydrogenase A inhibitors.
References Rupiani, S., et al.: J. Med. Chem., 101, 70 (2015)

Formula: C₉H₁₀O₃

Color and Shape: Neat

Molecular weight: 166.17

Ref: TR-M265555