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2-Propyl-4-pentenoic acid

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2-Propyl-4-pentenoic acid Basic information
Product Name:2-Propyl-4-pentenoic acid
Synonyms:2-allylpentanoicacid;2-allylvalericacid;2-propyl-4-pentenoicaci;4-en-valproicacid;4-ENEVALPROIC ACID;2-n-Propyl-4-pentenoic Acid;4-ene-VPA;2-PROPYL-PENT-4-ENOICACID
CAS:1575-72-0
MF:C8H14O2
MW:142.2
EINECS:
Product Categories:Pharmaceuticals;Intermediates & Fine Chemicals;Metabolites & Impurities
Mol File:1575-72-0.mol
2-Propyl-4-pentenoic acid Structure
2-Propyl-4-pentenoic acid Chemical Properties
Boiling point 95-100 °C(Press: 5 Torr)
density 0.943±0.06 g/cm3(Predicted)
storage temp. Refrigerator
solubility Methanol: Slightly Soluble
form An oil
pka4.70±0.20(Predicted)
color Colorless to light yellow
Stability:Toxic
Safety Information
ToxicityLD50 intraperitoneal in mouse: 1160mg/kg
MSDS Information
2-Propyl-4-pentenoic acid Usage And Synthesis
Description(±)-2-propyl-4-Pentenoic acid (4-ene VPA) is a major metabolite of valproic acid . It undergoes β-oxidation to form reactive metabolites that induce hepatotoxicity in rats. 4-ene VPA is also neuroteratogenic, reducing forebrain size and inducing deformation of the neural tube in mouse embryos.
Chemical PropertiesClear Colorless Oil
UsesA metabolite of Valproic Acid
DefinitionChEBI: 2-n-Propyl-4-pentenoic acid is a methyl-branched fatty acid.
HazardModerately toxic.
References[1] W TANG  F S A. A comparative investigation of 2-propyl-4-pentenoic acid (4-ene VPA) and its alpha-fluorinated analogue: phase II metabolism and pharmacokinetics.[J]. Drug Metabolism and Disposition, 1997, 25 2: 219-227.
[2] F. GOFFLOT . In vitro neuroteratogenicity of valproic acid and 4-en-VPA[J]. Neurotoxicology and teratology, 1995, 17 4: Pages 425-435. DOI: 10.1016/0892-0362(94)00094-t
2-Propyl-4-pentenoic acid Preparation Products And Raw materials
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