ChemSpider 2D Image | (16,16,16-~2~H_3_)Taxa-4,11-diene | C20H29D3

(16,16,16-2H3)Taxa-4,11-diene

  • Molecular FormulaC20H29D3
  • Average mass275.487 Da
  • Monoisotopic mass275.269226 Da
  • ChemSpider ID9646198

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(16,16,16-2H3)Taxa-4,11-dien [German] [ACD/IUPAC Name]
(16,16,16-2H3)Taxa-4,11-diene [ACD/IUPAC Name]
(16,16,16-2H3)Taxa-4,11-diène [French] [ACD/IUPAC Name]
6,10-Methanobenzocyclodecene, 1,2,4a,5,6,7,8,11,12,12a-decahydro-4,9,12a,13-tetramethyl-13-(methyl-d3)-, (4aS,6S,12aS)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 345.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.4 mmHg at 25°C
Enthalpy of Vaporization: 56.6±0.8 kJ/mol
Flash Point: 154.8±22.7 °C
Index of Refraction: 1.517
Molar Refractivity: 87.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 8.77
ACD/LogD (pH 5.5): 7.84
ACD/BCF (pH 5.5): 537618.81
ACD/KOC (pH 5.5): 439992.25
ACD/LogD (pH 7.4): 7.84
ACD/BCF (pH 7.4): 537618.81
ACD/KOC (pH 7.4): 439992.25
Polar Surface Area: 0 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 33.3±5.0 dyne/cm
Molar Volume: 289.5±5.0 cm3

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