ChemSpider 2D Image | (2Z,4Z)-2-Hydroxy-2,4-hexadienoate | C6H7O3

(2Z,4Z)-2-Hydroxy-2,4-hexadienoate

  • Molecular FormulaC6H7O3
  • Average mass127.118 Da
  • Monoisotopic mass127.040070 Da
  • ChemSpider ID26606385

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2Z,4Z)-2-Hydroxy-2,4-hexadienoat [German] [ACD/IUPAC Name]
(2Z,4Z)-2-Hydroxy-2,4-hexadienoate [ACD/IUPAC Name]
(2Z,4Z)-2-Hydroxy-2,4-hexadiénoate [French] [ACD/IUPAC Name]
(2Z,4Z)-2-hydroxyhexa-2,4-dienoate
2,4-Hexadienoic acid, 2-hydroxy-, ion(1-), (2Z,4Z)- [ACD/Index Name]
(Z,Z)-2-hydroxyhexa-2,4-dienoate

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CHEBI:63693 [DBID]
  • Miscellaneous

    • Chemical Class:

      A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of (2Z,4Z)-2-hydroxyhexa-2,4-dienoic acid. ChEBI CHEBI:63693

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point: 321.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 65.3±6.0 kJ/mol
Flash Point: 162.3±22.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.07
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.57
ACD/LogD (pH 7.4): -2.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 60 Å2
Polarizability:
Surface Tension:
Molar Volume:

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