2-Octenedioic acid

CAS Registry Number®

5698-50-0

CAS Name

2-Octenedioic acid

Molecular Formula

C8H12O4

Molecular Mass

172.18

Cite this Page

2-Octenedioic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5698-50-0 (retrieved 2024-11-12) (CAS RN: 5698-50-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    148 °C @ Press: 11 Torr

  • Melting Point (1)

    196-198 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6-8(11)12/h3,5H,1-2,4,6H2,(H,9,10)(H,11,12)

InChIKey

InChIKey=BNTPVRGYUHJFHN-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=CCCCCC(=O)O

Other Names for this Substance

  • 2-Octenedioic acid
  • 1-Hexene-1,6-dicarboxylic acid
  • NSC 14992
  • 2-Octene-1,8-dioic acid

Deleted or Replaced CAS Registry Numbers

2260832-11-7

CAS INSIGHTSTM
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