ChemSpider 2D Image | (1aR,3aS,6aR,6bS)-1,1,3a,6-Tetramethyl-1,1a,2,3,3a,3b,4,6b-octahydrocyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzene | C15H22

(1aR,3aS,6aR,6bS)-1,1,3a,6-Tetramethyl-1,1a,2,3,3a,3b,4,6b-octahydrocyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzene

  • Molecular FormulaC15H22
  • Average mass202.335 Da
  • Monoisotopic mass202.172150 Da
  • ChemSpider ID30772063

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

(1aR,3aS,6aR,6bS)-1,1,3a,6-Tetramethyl-1,1a,2,3,3a,3b,4,6b-octahydrocyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzene [ACD/IUPAC Name]
(1aR,3aS,6aR,6bS)-1,1,3a,6-Tétraméthyl-1,1a,2,3,3a,3b,4,6b-octahydrocyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzène [French] [ACD/IUPAC Name]
(1aR,3aS,6aR,6bS)-1,1,3a,6-Tetramethyl-1,1a,2,3,3a,3b,4,6b-octahydrocyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzol [German] [ACD/IUPAC Name]
Cyclopenta[2,3]cyclopropa[1,2-a]cyclopropa[c]benzene, 1,1a,2,3,3a,3b,4,6b-octahydro-1,1,3a,6-tetramethyl-, (1aR,3aS,6aR,6bS)- [ACD/Index Name]
Anastreptene

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

Density: 1.0±0.1 g/cm3
Boiling Point: 252.0±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 47.0±0.8 kJ/mol
Flash Point: 102.7±6.6 °C
Index of Refraction: 1.552
Molar Refractivity: 63.0±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 5.72
ACD/BCF (pH 5.5): 13140.47
ACD/KOC (pH 5.5): 30880.89
ACD/LogD (pH 7.4): 5.72
ACD/BCF (pH 7.4): 13140.47
ACD/KOC (pH 7.4): 30880.89
Polar Surface Area: 0 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 35.0±5.0 dyne/cm
Molar Volume: 197.2±5.0 cm3

Click to predict properties on the Chemicalize site


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