ChemSpider 2D Image | (1R,2S,9R,13S)-1,6,6,10,13-Pentamethyl-10-vinyltricyclo[7.3.1.0~2,7~]tridec-7-ene | C20H32

(1R,2S,9R,13S)-1,6,6,10,13-Pentamethyl-10-vinyltricyclo[7.3.1.02,7]tridec-7-ene

  • Molecular FormulaC20H32
  • Average mass272.468 Da
  • Monoisotopic mass272.250397 Da
  • ChemSpider ID26331711

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(1R,2S,9R,13S)-1,6,6,10,13-Pentamethyl-10-vinyltricyclo[7.3.1.02,7]tridec-7-en [German] [ACD/IUPAC Name]
(1R,2S,9R,13S)-1,6,6,10,13-Pentamethyl-10-vinyltricyclo[7.3.1.02,7]tridec-7-ene [ACD/IUPAC Name]
(1R,2S,9R,13S)-1,6,6,10,13-Pentaméthyl-10-vinyltricyclo[7.3.1.02,7]tridéc-7-ène [French] [ACD/IUPAC Name]
(4aS,5R,9R,11S)-1,1,5,8,11-pentamethyl-8-vinyl-1,2,3,4,4a,5,6,7,8,9-decahydro-5,9-methanobenzocyclooctene
5,9-Methanobenzocyclooctene, 8-ethenyl-1,2,3,4,4a,5,6,7,8,9-decahydro-1,1,5,8,11-pentamethyl-, (4aS,5R,9R,11S)- [ACD/Index Name]
(4aS,5R,9R,11S)-8-ethenyl-1,1,5,8,11-pentamethyl-1,2,3,4,4a,5,6,7,8,9-decahydro-5,9-methanobenzocyclooctene
edaxadiene

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

12141156 [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 333.4±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 55.3±0.8 kJ/mol
Flash Point: 148.8±14.4 °C
Index of Refraction: 1.513
Molar Refractivity: 87.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 8.53
ACD/LogD (pH 5.5): 7.70
ACD/BCF (pH 5.5): 416037.09
ACD/KOC (pH 5.5): 366224.50
ACD/LogD (pH 7.4): 7.70
ACD/BCF (pH 7.4): 416037.09
ACD/KOC (pH 7.4): 366224.50
Polar Surface Area: 0 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 32.4±5.0 dyne/cm
Molar Volume: 292.8±5.0 cm3

Click to predict properties on the Chemicalize site


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