trans-Aconitic acid

CAS Registry Number®

4023-65-8

CAS Name

trans-Aconitic acid

Molecular Formula

C6H6O6

Molecular Mass

174.11

Cite this Page

trans-Aconitic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4023-65-8 (retrieved 2024-11-21) (CAS RN: 4023-65-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    173 °C

Source(s)

Other Names and Identifiers

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

InChIKey=GTZCVFVGUGFEME-HNQUOIGGSA-N

SMILES

C(\CC(O)=O)(=C\C(O)=O)/C(O)=O

Canonical SMILES

O=C(O)C=C(C(=O)O)CC(=O)O

Other Names for this Substance

  • 1-Propene-1,2,3-tricarboxylic acid, (1E)-
  • 1-Propene-1,2,3-tricarboxylic acid, (E)-
  • Aconitic acid, trans-
  • (1E)-1-Propene-1,2,3-tricarboxylic acid
  • trans-Aconitic acid

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CAS INSIGHTSTM
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