ChemSpider 2D Image | (4beta,5beta,6beta,7beta)-Aristol-1(10)-ene | C15H24

(4β,5β,6β,7β)-Aristol-1(10)-ene

  • Molecular FormulaC15H24
  • Average mass204.351 Da
  • Monoisotopic mass204.187805 Da
  • ChemSpider ID57261590
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(4β,5β,6β,7β)-Aristol-1(10)-en [German] [ACD/IUPAC Name]
(4β,5β,6β,7β)-Aristol-1(10)-ene [ACD/IUPAC Name]
(4β,5β,6β,7β)-Aristol-1(10)-ène [French] [ACD/IUPAC Name]
1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-, (1aS,7S,7aS,7bR)- [ACD/Index Name]
(+)-Calarene
17334-55-3 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 259.9±7.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 47.7±0.8 kJ/mol
Flash Point: 99.3±13.0 °C
Index of Refraction: 1.515
Molar Refractivity: 65.0±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 6.34
ACD/LogD (pH 5.5): 6.09
ACD/BCF (pH 5.5): 24803.10
ACD/KOC (pH 5.5): 48660.09
ACD/LogD (pH 7.4): 6.09
ACD/BCF (pH 7.4): 24803.10
ACD/KOC (pH 7.4): 48660.09
Polar Surface Area: 0 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 32.0±5.0 dyne/cm
Molar Volume: 215.5±5.0 cm3

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