Found 489 results

Search term: MF = 'C_{33}H_{29}N_{3}O_{5}'
ChemSpider 2D Image | 1-[(9-Ethyl-9H-carbazol-3-yl)amino]-1-oxo-2-propanyl 4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoate | C33H29N3O5

1-[(9-Ethyl-9H-carbazol-3-yl)amino]-1-oxo-2-propanyl 4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoate

  • Molecular FormulaC33H29N3O5
  • Average mass547.601 Da
  • Monoisotopic mass547.210693 Da
  • ChemSpider ID4019120

More details:

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

1-[(9-Ethyl-9H-carbazol-3-yl)amino]-1-oxo-2-propanyl 4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoate [ACD/IUPAC Name]
1-[(9-Ethyl-9H-carbazol-3-yl)amino]-1-oxo-2-propanyl-4-(1,3-dioxo-1H-benzo[de]isochinolin-2(3H)-yl)butanoat [German] [ACD/IUPAC Name]
1H-Benz[de]isoquinoline-2(3H)-butanoic acid, 1,3-dioxo-, 2-[(9-ethyl-9H-carbazol-3-yl)amino]-1-methyl-2-oxoethyl ester [ACD/Index Name]
4-(1,3-Dioxo-1H-benzo[de]isoquinoléin-2(3H)-yl)butanoate de 1-[(9-éthyl-9H-carbazol-3-yl)amino]-1-oxo-2-propanyle [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: 767.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 417.8±32.9 °C
Index of Refraction: 1.675
Molar Refractivity: 154.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 5.43
ACD/BCF (pH 5.5): 7933.57
ACD/KOC (pH 5.5): 21519.22
ACD/LogD (pH 7.4): 5.43
ACD/BCF (pH 7.4): 7933.79
ACD/KOC (pH 7.4): 21519.81
Polar Surface Area: 98 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 412.0±7.0 cm3

Click to predict properties on the Chemicalize site


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