Found 8 results

Search term: MF = 'C_{54}H_{78}N_{2}O_{9}'
ChemSpider 2D Image | N-{6a-(Allyloxy)-10-(3-formylphenoxy)-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}-N-propyldodecanamide | C54H78N2O9

N-{6a-(Allyloxy)-10-(3-formylphenoxy)-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}-N-propyldodecanamide

  • Molecular FormulaC54H78N2O9
  • Average mass899.205 Da
  • Monoisotopic mass898.570740 Da
  • ChemSpider ID3510972

More details:

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

Dodecanamide, N-[10-(3-formylphenoxy)-1,2,4,5,6,6a,11b,11c-octahydro-1,2-bis(4-hydroxybutyl)-6a-(2-propen-1-yloxy)-4-[[(tetrahydro-2H-pyran-2-yl)oxy]imino]benzo[kl]xanthen-6-yl]-N-propyl- [ACD/Index Name]
N-{6a-(Allyloxy)-10-(3-formylphenoxy)-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}-N-propyldodecanamid [German] [ACD/IUPAC Name]
N-{6a-(Allyloxy)-10-(3-formylphenoxy)-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}-N-propyldodecanamide [ACD/IUPAC Name]
N-{6a-(Allyloxy)-10-(3-formylphénoxy)-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}-N-propyldodécanamide [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: 930.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.8±3.0 kJ/mol
Flash Point: 516.7±37.1 °C
Index of Refraction: 1.575
Molar Refractivity: 253.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 3
ACD/LogP: 11.53
ACD/LogD (pH 5.5): 11.44
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.44
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 136 Å2
Polarizability: 100.5±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 767.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement