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Search term: 78435838 (Found by CSID)

ChemSpider 2D Image | (2Z)-2-Hexyl-2-pentenedioic acid | C11H18O4

(2Z)-2-Hexyl-2-pentenedioic acid

  • Molecular FormulaC11H18O4
  • Average mass214.258 Da
  • Monoisotopic mass214.120514 Da
  • ChemSpider ID78435838
  • Double-bond stereo - Double-bond stereo


More details:






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

(2Z)-2-Hexyl-2-pentendisäure [German] [ACD/IUPAC Name]
(2Z)-2-Hexyl-2-pentenedioic acid [ACD/IUPAC Name]
2-Pentenedioic acid, 2-hexyl-, (2Z)- [ACD/Index Name]
Acide (2Z)-2-hexyl-2-pentènedioïque [French] [ACD/IUPAC Name]
(Z)-2-hexylpent-2-enedioic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 418.9±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 73.8±6.0 kJ/mol
Flash Point: 221.3±20.5 °C
Index of Refraction: 1.493
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 1.05
ACD/KOC (pH 5.5): 11.89
ACD/LogD (pH 7.4): -1.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 192.8±3.0 cm3

Click to predict properties on the Chemicalize site






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