ChemSpider 2D Image | Quadricyclane | C7H8

Quadricyclane

  • Molecular FormulaC7H8
  • Average mass92.138 Da
  • Monoisotopic mass92.062599 Da
  • ChemSpider ID30796462
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

(1R,2s,4s,5S,6R,7S)-Tetracyclo[3.2.0.02,7.04,6]heptan [German] [ACD/IUPAC Name]
(1R,2s,4s,5S,6R,7S)-Tetracyclo[3.2.0.02,7.04,6]heptane [ACD/IUPAC Name]
(1R,2s,4s,5S,6R,7S)-Tétracyclo[3.2.0.02,7.04,6]heptane [French] [ACD/IUPAC Name]
205-994-1 [EINECS]
278-06-8 [RN]
8E0K9BG24C
Quadricyclane [Wiki]
quadricyclo[2.2.1.02,6.03.5]heptane
tetracyclo[2.2.1.02,6.03,5]heptane
Tetracyclo[3.2.0.02,7.04,6]heptane, (1R,5S,6R,7S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 108.1±7.0 °C at 760 mmHg
Vapour Pressure: 30.7±0.1 mmHg at 25°C
Enthalpy of Vaporization: 33.3±0.8 kJ/mol
Flash Point: 11.1±0.0 °C
Index of Refraction: 1.716
Molar Refractivity: 26.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 59.18
ACD/KOC (pH 5.5): 645.85
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 59.18
ACD/KOC (pH 7.4): 645.85
Polar Surface Area: 0 Å2
Polarizability: 10.5±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 67.3±3.0 cm3

Click to predict properties on the Chemicalize site





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