CAS 111348-61-9

S-trichlorovinyl-N-acetylcysteine

Description:

S-trichlorovinyl-N-acetylcysteine, identified by its CAS number 111348-61-9, is a synthetic compound that combines elements of both a trichlorovinyl group and N-acetylcysteine, an amino acid derivative. This compound is characterized by its unique structure, which includes a trichlorovinyl moiety that imparts significant reactivity, particularly in biological systems. It is known for its potential applications in medicinal chemistry, particularly as a precursor or intermediate in the synthesis of pharmaceuticals. The presence of the N-acetylcysteine component suggests that it may exhibit antioxidant properties, as N-acetylcysteine is recognized for its ability to replenish intracellular levels of glutathione, a critical antioxidant. Additionally, the trichlorovinyl group may contribute to its reactivity with various biological targets, potentially influencing its pharmacological effects. Overall, S-trichlorovinyl-N-acetylcysteine represents a compound of interest in both chemical research and therapeutic development, warranting further investigation into its properties and applications.

Formula: C₇H₈Cl₃NO₃S

InChI: InChI=1/C7H8Cl3NO3S/c1-3(12)11-4(7(13)14)2-15-6(10)5(8)9/h4H,2H2,1H3,(H,11,12)(H,13,14)/t4-/m0/s1

SMILES: CC(=N[C@@H](CSC(=C(Cl)Cl)Cl)C(=O)O)O

Synonyms:

• Ccris 1307
• N-Acetyl-S-(trichloroethenyl)-L-cysteine
• L-Cysteine, N-acetyl-S-(trichloroethenyl)-
• S-Trichlorovinyl-N-acetylcysteine
• N-Acetyl-S-(trichlorovinyl)-L-cysteine
• L-Cysteine, N-acetyl-S-(1,2,2-trichloroethenyl)-
• N-Acetyl-S-(1,2,2-trichloroethenyl)-L-cysteine
• N-Ac-TCVC

N-Acetyl-S-(trichlorovinyl)-L-cysteine

Controlled Product

CAS: 111348-61-9

Stability Light Sensitive
Applications A novel metabolite of Perchloroethene (PER) in humans after inhalation. It is an important biomarker for the glutathione dependent biotransformation of PER.
References Urban, G., et al.: Xenobiotica, 24, 881 (1994), Birner, G., et al.: Drug Metab. Dispos., 24, 41 (1996), Dekant, W., et al.: Drug Metab. Dispos., 15, 702 (1987),

Formula: C₇H₈Cl₃NO₃S

Color and Shape: Neat

Molecular weight: 292.57

Ref: TR-A189580

N-Acetyl-S-(trichlorovinyl)-L-cysteine

CAS: 111348-61-9

N-Acetyl-S-(trichlorovinyl)-L-cysteine is a recombinant protein that is produced by the chemical ionization of human cytochrome P450 1A1 (CYP1A1) using trichloroacetic acid. The reactive intermediate is conjugated to an anti-bacterial antibody that binds to bacterial enzymes, such as bacterial cytosolic enzymes, and prevents their activity. This treatment has been shown to be effective in experimental infection models in mice. N-Acetyl-S-(trichlorovinyl)-L-cysteine is also capable of increasing the antibody response in humans. It can be used for the diagnosis of chronic exposure to perchloroethylene, which is a chemical that can cause liver damage.

Formula: C₇H₈Cl₃NO₃S

Purity: Min. 95 Area-%

Color and Shape: Powder

Molecular weight: 292.57 g/mol

Ref: 3D-FA17175

N-Acetyl-S-(trichlorovinyl)-L-cysteine

CAS: 111348-61-9

Formula: C₇H₈Cl₃NO₃S

Molecular weight: 292.57

Ref: ST-EA-CP-G55035