CAS 616-75-1

Benzylmalonic acid

Description:

Benzylmalonic acid, with the CAS number 616-75-1, is an organic compound characterized by its structure, which features a malonic acid backbone with a benzyl group attached. This compound typically appears as a white to off-white crystalline solid and is soluble in polar solvents such as water and alcohols. Benzylmalonic acid is known for its ability to participate in various chemical reactions, including esterification and condensation, making it useful in organic synthesis. It can serve as a building block for more complex molecules and is often utilized in the synthesis of pharmaceuticals and agrochemicals. The presence of both carboxylic acid groups allows for potential reactivity, while the benzyl group can enhance lipophilicity and influence the compound's biological activity. Additionally, benzylmalonic acid may exhibit properties such as moderate melting and boiling points, which are typical for similar organic acids. As with many organic compounds, handling should be done with care, considering potential hazards associated with its chemical reactivity.

Formula: C₁₀H₁₀O₄

InChI: InChI=1S/C10H10O4/c11-9(12)8(10(13)14)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)(H,13,14)

InChI key: InChIKey=JAEJSNFTJMYIEF-UHFFFAOYSA-N

SMILES: C(CC1=CC=CC=C1)(C(O)=O)C(O)=O

Synonyms:

• (Cyclohexylmethyl)Propanedioate
• 1,1-Ethanedicarboxylic acid, 2-phenyl-
• 2-(Phenylmethyl)propanedioic acid
• 2-Benzylmalonate
• 2-Benzylmalonic acid
• 2-Benzylpropanedioic acid
• Ai3-23865
• Benzomalonate acid
• Benzylpropanedioic Acid
• Brn 0643530
• Malonic acid, 2-benzyl-
• Malonic acid, benzyl-
• Nsc 8068
• Propanedioic acid, (phenylmethyl)-
• Propanedioic acid, (phenylmethyl)- (9CI)
• Propanedioic acid, 2-(phenylmethyl)-
• Usaf Xr-36

Benzylmalonic Acid

CAS: 616-75-1

Formula: C₁₀H₁₀O₄

Purity: >98.0%(GC)(T)

Color and Shape: White to Almost white powder to crystal

Molecular weight: 194.19

Ref: 3B-B0422

2-Benzylmalonic acid

CAS: 616-75-1

Formula: C₁₀H₁₀O₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 194.1840

Ref: IN-DA003GL7

Benzylmalonic acid

CAS: 616-75-1

Benzylmalonic acid

Purity: 98%

Molecular weight: 194.18g/mol

Ref: 54-OR920047

Benzylmalonic acid

CAS: 616-75-1

Benzylmalonic acid is a chemical that has been used to study the role of ATP-binding cassette transporter (ABC) proteins in autoimmune diseases. ABC proteins are involved in transporting molecules across cell membranes, and their dysfunction leads to the development of autoimmune diseases. Benzylmalonic acid binds to the receptor site on ABC proteins and blocks their function, inhibiting the production of inflammatory cytokines. This agent also binds to picolinic acid, which is an intermediate metabolite in the kynurenine pathway that is linked to inflammatory response. The structure of benzylmalonic acid may be responsible for its effects on congestive heart disease because it can bind with phosphorus pentoxide and form a precipitate that may interfere with calcium binding. This drug has also shown anti-inflammatory properties as well as cardiotoxic effects when used at high doses.

Formula: C₁₀H₁₀O₄

Purity: Min. 95%

Color and Shape: White Powder

Molecular weight: 194.18 g/mol

Ref: 3D-FB18395

2-Benzylmalonic acid

CAS: 616-75-1

Formula: C₁₀H₁₀O₄

Purity: 98%

Molecular weight: 194.186

Ref: 10-F235755