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Basic information
- CAS
111348-61-9- Standard SMILES
CC(=O)N[C@@H](CSC(Cl)=C(Cl)Cl)C(=O)O- InChIKey
NBGLMNHGJFSOCH-BYPYZUCNSA-N- Molecular formula
- C7H8Cl3NO3S
- Average molar mass
- 292.571 g/mol
- Monoisotopic mass
- 290.92904716
Names & identifiers
- Preferred name
- S-Trichlorovinyl-N-acetylcysteine
- IUPAC
- N-Acetyl-S-(trichloroethenyl)-L-cysteine
- English name
- S-trichlorovinyl-N-acetylcysteine
- Molecular formula
- C7H8Cl3NO3S
- Molecular weight
- 292.57
Names & synonyms
N-Acetyl-S-(trichlorovinyl)-L-cysteineN-Ac-TCVCS-trichlorovinyl-N-acetylcysteineN-Acetyl-S-(1,2,2-trichloroethenyl)-L-cysteineL-Cysteine, N-acetyl-S-(1,2,2-trichloroethenyl)-
Database identifiers
- CAS
111348-61-9- PubChem CID
- 119577
- DTXSID
DTXSID20149602- ChEBI
CHEBI:165889- UNII
- OKQ3S0EJ8Y
- Nikkaji
- J702.566A
Properties
Physicochemical properties
- Melting point
- 150 · 150-152°C
- storage temp.
- -20 °C · Amber Vial, -20°C Freezer, Under inert atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Pale Beige to Beige
- Stability
- Light Sensitive
- FDA UNII
- 3 S0EJ8Y · OKQ3S0EJ8Y
Chemistry & industry
Applications
UsesA novel metabolite of Perchloroethene (PER) in humans after inhalation. It is an important biomarker for the glutathione dependent biotransformation of PER.
Suppliers11 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Additional notes
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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