ChemSpider 2D Image | 6,6-dimethyl-2-heptene | C9H18

6,6-dimethyl-2-heptene

  • Molecular FormulaC9H18
  • Average mass126.239 Da
  • Monoisotopic mass126.140854 Da
  • ChemSpider ID57560825

More details:






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

2-HEPTENE, 6,6-DIMETHYL- [ACD/Index Name]
6,6-Dimethyl-2-hepten [German] [ACD/IUPAC Name]
6,6-dimethyl-2-heptene [ACD/IUPAC Name]
6,6-Diméthyl-2-heptène [French] [ACD/IUPAC Name]
6,6-Dimethylhept-2-ene
87970-30-7 [RN]

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

Density: 0.7±0.1 g/cm3
Boiling Point: 135.0±7.0 °C at 760 mmHg
Vapour Pressure: 9.7±0.1 mmHg at 25°C
Enthalpy of Vaporization: 35.7±0.8 kJ/mol
Flash Point: 24.4±9.2 °C
Index of Refraction: 1.426
Molar Refractivity: 43.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 937.17
ACD/KOC (pH 5.5): 4664.74
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 937.17
ACD/KOC (pH 7.4): 4664.74
Polar Surface Area: 0 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 22.7±3.0 dyne/cm
Molar Volume: 170.8±3.0 cm3

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