Found 11 results

Search term: MF = 'C_{54}H_{59}N_{3}O_{10}'
ChemSpider 2D Image | N-[6a-(Allyloxy)-10-(3-formylphenoxy)-1,2-bis(4-hydroxybutyl)-4-{[(2-methyl-2-propanyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl]-N-(1,3-benzodioxol-5-ylmethyl)-4-cyanobenzamide | C54H59N3O10

N-[6a-(Allyloxy)-10-(3-formylphenoxy)-1,2-bis(4-hydroxybutyl)-4-{[(2-methyl-2-propanyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl]-N-(1,3-benzodioxol-5-ylmethyl)-4-cyanobenzamide

  • Molecular FormulaC54H59N3O10
  • Average mass910.060 Da
  • Monoisotopic mass909.420044 Da
  • ChemSpider ID2826490

More details:

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

Benzamide, N-(1,3-benzodioxol-5-ylmethyl)-4-cyano-N-[4-[(1,1-dimethylethoxy)imino]-10-(3-formylphenoxy)-1,2,4,5,6,6a,11b,11c-octahydro-1,2-bis(4-hydroxybutyl)-6a-(2-propen-1-yloxy)benzo[kl]xanthen-6-y l]- [ACD/Index Name]
N-[6a-(Allyloxy)-10-(3-formylphenoxy)-1,2-bis(4-hydroxybutyl)-4-{[(2-methyl-2-propanyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl]-N-(1,3-benzodioxol-5-ylmethyl)-4-cyanbenzamid [German] [ACD/IUPAC Name]
N-[6a-(Allyloxy)-10-(3-formylphenoxy)-1,2-bis(4-hydroxybutyl)-4-{[(2-methyl-2-propanyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl]-N-(1,3-benzodioxol-5-ylmethyl)-4-cyanobenzamide [ACD/IUPAC Name]
N-[6a-(Allyloxy)-10-(3-formylphénoxy)-1,2-bis(4-hydroxybutyl)-4-{[(2-méthyl-2-propanyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthén-6-yl]-N-(1,3-benzodioxol-5-ylméthyl)-4-cyanobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 990.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.4±3.0 kJ/mol
Flash Point: 553.1±37.1 °C
Index of Refraction: 1.619
Molar Refractivity: 252.0±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: 8.76
ACD/LogD (pH 5.5): 8.28
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 763519.50
ACD/LogD (pH 7.4): 8.28
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 763519.50
Polar Surface Area: 169 Å2
Polarizability: 99.9±0.5 10-24cm3
Surface Tension: 48.9±7.0 dyne/cm
Molar Volume: 718.1±7.0 cm3

Click to predict properties on the Chemicalize site


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