ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-N-{6a,10-bis(allyloxy)-1,2-bis(4-hydroxybutyl)-4-[(tetrahydro-2H-pyran-2-yloxy)imino]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}dodecanamide | C55H78N2O10

N-(1,3-Benzodioxol-5-ylmethyl)-N-{6a,10-bis(allyloxy)-1,2-bis(4-hydroxybutyl)-4-[(tetrahydro-2H-pyran-2-yloxy)imino]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}dodecanamide

  • Molecular FormulaC55H78N2O10
  • Average mass927.215 Da
  • Monoisotopic mass926.565674 Da
  • ChemSpider ID2856540

More details:

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

Dodecanamide, N-(1,3-benzodioxol-5-ylmethyl)-N-[1,2,4,5,6,6a,11b,11c-octahydro-1,2-bis(4-hydroxybutyl)-6a,10-bis(2-propen-1-yloxy)-4-[[(tetrahydro-2H-pyran-2-yl)oxy]imino]benzo[kl]xanthen-6-yl]- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-{6a,10-bis(allyloxy)-1,2-bis(4-hydroxybutyl)-4-[(tetrahydro-2H-pyran-2-yloxy)imino]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}dodecanamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-N-{6a,10-bis(allyloxy)-1,2-bis(4-hydroxybutyl)-4-[(tetrahydro-2H-pyran-2-yloxy)imino]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl}dodecanamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-N-{6a,10-bis(allyloxy)-1,2-bis(4-hydroxybutyl)-4-[(tétrahydro-2H-pyran-2-yloxy)imino]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthén-6-yl}dodécanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 947.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 144.5±3.0 kJ/mol
Flash Point: 526.8±37.1 °C
Index of Refraction: 1.583
Molar Refractivity: 257.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 3
ACD/LogP: 12.36
ACD/LogD (pH 5.5): 11.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 138 Å2
Polarizability: 102.1±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 770.7±7.0 cm3

Click to predict properties on the Chemicalize site


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