CAS 1642-51-9

3-[(dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid

Description:

3-[(Dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid, with the CAS number 1642-51-9, is a chemical compound that features a complex structure incorporating both phosphorothioate and carboxylic acid functional groups. This compound is characterized by the presence of a dimethoxyphosphorothioyl group, which contributes to its potential reactivity and biological activity. The ethoxy group enhances its solubility in organic solvents, while the oxobutanoic acid moiety suggests potential applications in organic synthesis or as a biochemical agent. The presence of sulfur in the sulfanyl group indicates that it may exhibit unique properties, such as increased nucleophilicity or specific interactions with biological targets. Additionally, the compound's structure suggests it may participate in various chemical reactions, including nucleophilic substitutions or hydrolysis. Overall, this compound's unique combination of functional groups may make it of interest in fields such as medicinal chemistry, agrochemicals, or materials science. However, specific safety and handling guidelines should be followed due to the potential toxicity associated with phosphorothioate compounds.

Formula: C₈H₁₅O₆PS₂

InChI: InChI=1/C6H10O4S.C2H7O2PS2/c1-2-10-6(9)4(11)3-5(7)8;1-3-5(6,7)4-2/h4,11H,2-3H2,1H3,(H,7,8);1-2H3,(H,6,7)/p-1

SMILES: CCOC(=O)C(CC(=O)[O-])S.COP(=S)(OC)S

Synonyms:

• Butanedioic Acid, 2-[(Dimethoxyphosphinothioyl)Thio]-, 1-Ethyl Ester
• 3-[(Dimethoxyphosphorothioyl)sulfanyl]-4-ethoxy-4-oxobutanoic acid
• Malathion β-Monoacid
• O,O-DiMethyl S-(1-Carbethoxy-2-carboxy)ethyl Phosphorodithioate
• S-[2-Carboxy-1-(ethoxycarbonyl)ethyl]O,O-di-Methyl Phosphorodithioate
• Malathion β-Monocarboxylic Acid
• 2-[(DiMethoxyphosphinothioyl)thio]butanedioic Acid 1-Ethyl Ester
• Malathion Impurity 3(Malathion β-Monoacid)

Malathion β-Monoacid

CAS: 1642-51-9

Stability Hygroscopic
Applications A major biodegradation product of Malathion (M111000).
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Kim, Y. et al.: Chemosphere, 60, 1349 (2005); Yoshii, K. et al.: J. Health Sci., 54, 535 (2008); Hayasaka, M. et al.: Jap. J. Forensic Toxicol., 12, 15 (1994);

Formula: C₈H₁₅O₆PS₂

Color and Shape: Neat

Molecular weight: 302.30

Ref: TR-M111020

Malathion β-monoacid

CAS: 1642-51-9

Malathion β-monoacid is a potent inhibitor of kinases, which play a crucial role in the regulation of cell cycle and apoptosis. It has been shown to induce apoptosis in leukemia and cancer cells by inhibiting protein kinase activity. Malathion β-monoacid has also been found to have medicinal properties as an anticancer agent. Studies have demonstrated its ability to inhibit tumor growth in Chinese hamster ovary cells and human bladder cancer cells. Additionally, it has been observed that this compound can be detected in urine after exposure to malathion, indicating its potential use as a biomarker for malathion exposure. Overall, Malathion β-monoacid is a promising candidate for further investigation as an anticancer drug.

Formula: C₈H₁₅O₆PS₂

Purity: Min. 95%

Molecular weight: 302.3 g/mol

Ref: 3D-BAA64251