ChemSpider 2D Image | (5E)-7-Chloro-1,5-heptadien-3-yne | C7H7Cl

(5E)-7-Chloro-1,5-heptadien-3-yne

  • Molecular FormulaC7H7Cl
  • Average mass126.584 Da
  • Monoisotopic mass126.023628 Da
  • ChemSpider ID32993498
  • Double-bond stereo - Double-bond stereo


More details:






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

(5E)-7-Chlor-1,5-heptadien-3-in [German] [ACD/IUPAC Name]
(5E)-7-Chloro-1,5-heptadien-3-yne [ACD/IUPAC Name]
(5E)-7-Chloro-1,5-heptadién-3-yne [French] [ACD/IUPAC Name]
1,5-Heptadien-3-yne, 7-chloro-, (5E)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 171.5±23.0 °C at 760 mmHg
Vapour Pressure: 1.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.1±3.0 kJ/mol
Flash Point: 53.2±18.0 °C
Index of Refraction: 1.494
Molar Refractivity: 37.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 105.98
ACD/KOC (pH 5.5): 980.07
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 105.98
ACD/KOC (pH 7.4): 980.07
Polar Surface Area: 0 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 32.1±3.0 dyne/cm
Molar Volume: 127.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement