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HCID 25975Erstellt: 26. Oktober 2026

Dichloroacetate anion

dichloroacetate ion · Dichloroacetate anion · ACETICACID,DICHLORO-,ION(1-)

https://huagongshe.com/de/chemical/25975

Molekülstruktur von Dichloroacetate anion

Identifikatoren & physikalische Daten

CAS No.13425-80-4
SummenformelC2HCl2O2-
Durchschnittliche Molmasse127,93 g/mol
Monoisotopische Masse126,93590821 g/mol
SMILESO=C([O-])C(Cl)Cl
InChIKeyJXTHNDFMNIQAHM-UHFFFAOYSA-M
PubChem CID25975
ChEBICHEBI:28240
DTXSIDDTXSID40158610

Chemische & physikalische Eigenschaften

XLogP1,8
Polarare Oberfläche (TPSA)40,1
H-Brücken-Donoren0
H-Brücken-Akzeptoren2
Frei drehbare Bindungen0
Schwere Atome6
Formalladung-1
Komplexität55,1

Sicherheit & Vorschriften

Gesundheitliche AuswirkungenMultiple independent studies demonstrate that DCA has the ability to alter normal carbohydrate metabolism. Dichloroacetic acid treatment results in a significant reduction in plasma levels of glucose, pyruvate, and lactate. Another consistent finding in DCA ingestion studies is a dose-related increase in liver size, generally accompanied (or caused) by an increase in glycogen deposition in the liver. There is an extensive and consistent data base demonstrating the reproductive toxicity of DCA in males and females. Neurologic symptoms and morphologic changes in the nervous system have been reported in humans, dogs, and rats. (L2086)
ExpositionspfadeIngestion
ToxizitätsübersichtThe dichloroacetate ion stimulates the activity of the enzyme pyruvate dehydrogenase by inhibiting the enzyme pyruvate dehydrogenase kinase. Thus, it decreases lactate production by shifting the metabolism of pyruvate from fermentation towards oxidation in the mitochondria. (Wikipedia)
Carcinogen Classification2B, possibly carcinogenic to humans. (L135)
Toxicity DataORAL (LD50): Acute: 2820 mg/kg [Rat]DERMAL (LD50): Acute: 510 mg/kg [Rabbit]