A metabolite of tetrachloroethylene
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N-acetyl-S-(trichlorovinyl)-L-Cysteine

Item No. 35086

Product Insert (PDF)Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
N-acetyl-S-(1,2,2-trichloroethenyl)-L-cysteine
CAS Number
111348-61-9
Molecular Formula
C7H8Cl3NO3S
Formula Weight
292.6
Purity
≥90%
Formulation (Request formulation change)
A solid
Solubility(Learn about Variance in Solubility)
Chloroform: soluble
SMILES
Cl/C(Cl)=C(Cl)\SC[C@@H](C(O)=O)NC(C)=O
InChi Code
InChI=1S/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
InChi Key
NBGLMNHGJFSOCH-BYPYZUCNSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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    5 mg

    $128

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    10 mg

    $229

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    25 mg

    $537

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    Cayman Chemical
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    ENVIRONMENTAL TOXICOLOGY TOOLS & SERVICES
    Product Description

    N-acetyl-S-(trichlorovinyl)-L-Cysteine is a metabolite of the volatile organic compound (VOC) and environmental contaminant tetrachloroethylene (perchloroethylene; PERC).1,2

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Luo, Y.-S., Cichocki, J.A., McDonald, T.J., et al. Simultaneous detection of the tetrachloroethylene metabolites S-(1,2,2-trichlorovinyl) glutathione, S-(1,2,2-trichlorovinyl)-L-cysteine, and N-acetyl-S-(1,2,2-trichlorovinyl)-L-cysteine in multiple mouse tissues via ultra-high performance liquid chromatography electrospray ionization tandem mass spectrometry. J. Toxicol. Environ. Health A 80(9), 513-524 (2017).

    2. Birner, G., Rutkowska, A., and Dekant, W. N-acetyl-S-(1,2,2-trichlorovinyl)-ʟ-cysteine and 2,2,2-trichloroethanol: Two novel metabolites of tetrachloroethene in humans after occupational exposure. Drug Metab. Dispos. 24(1), 41-48 (1996).