ChemSpider 2D Image | (1E,5E)-1-Chloro-1,2,3,5-heptatetraene | C7H7Cl

(1E,5E)-1-Chloro-1,2,3,5-heptatetraene

  • Molecular FormulaC7H7Cl
  • Average mass126.584 Da
  • Monoisotopic mass126.023628 Da
  • ChemSpider ID61117550
  • Double-bond stereo - Double-bond stereo


More details:






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

(1E,5E)-1-Chlor-1,2,3,5-heptatetraen [German] [ACD/IUPAC Name]
(1E,5E)-1-Chloro-1,2,3,5-heptatetraene [ACD/IUPAC Name]
(1E,5E)-1-Chloro-1,2,3,5-heptatétraène [French] [ACD/IUPAC Name]
1,2,3,5-Heptatetraene, 1-chloro-, (1E,5E)- [ACD/Index Name]
1824823-72-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 198.5±7.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.7±3.0 kJ/mol
Flash Point: 69.3±13.6 °C
Index of Refraction: 1.475
Molar Refractivity: 39.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.47
ACD/KOC (pH 5.5): 970.08
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 104.47
ACD/KOC (pH 7.4): 970.08
Polar Surface Area: 0 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 8.7±3.0 dyne/cm
Molar Volume: 140.0±3.0 cm3

Click to predict properties on the Chemicalize site






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