Trans-Aconitic Acid

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Catalog Number ACM4023658
CAS 4023-65-8
Structure {[CurrentData.Name]}
Description Solid;Solid;colourless or yellow crystals, leaves, or plates; pleasant winey acid taste; almost odourless
IUPAC Name (E)-Prop-1-ene-1,2,3-tricarboxylic acid
Synonyms Achilleic acid
Molecular Weight 174.11
Molecular Formula C6H6O6
Canonical SMILES C(C(=CC(=O)O)C(=O)O)C(=O)O
Inchi InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+
InChIKey GTZCVFVGUGFEME-HNQUOIGGSA-N
Boiling Point 225.05 °C
Melting Point 190 °C(lit.)
Flash Point 296 °C
Purity 98%
Density 0.56 g/cm³ at 20 °C
Solubility Soluble in water, alcohol
Appearance White to off-white solid
Storage Store below +30 °C
Refractive Index 1.5860

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