ChemSpider 2D Image | 5-(4-Butoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione | C30H32N2O7

5-(4-Butoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

  • Molecular FormulaC30H32N2O7
  • Average mass532.584 Da
  • Monoisotopic mass532.220947 Da
  • ChemSpider ID3072752

More details:

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

2H-Pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione, 5-(4-butoxyphenyl)dihydro-2-phenyl-3-(2,4,5-trimethoxyphenyl)- [ACD/Index Name]
5-(4-Butoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazol-4,6(3H,5H)-dion [German] [ACD/IUPAC Name]
5-(4-Butoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione [ACD/IUPAC Name]
5-(4-Butoxyphényl)-2-phényl-3-(2,4,5-triméthoxyphényl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione [French] [ACD/IUPAC Name]
1023235-97-3 [RN]
5-(4-butoxyphenyl)-2-phenyl-3-(2,4,5-trimethoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
AC1MZFYV
AGN-PC-0L0X5H
AKOS022089417
MCULE-1718034791
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 719.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 389.1±35.7 °C
Index of Refraction: 1.589
Molar Refractivity: 144.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 673.31
ACD/KOC (pH 5.5): 3681.59
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 673.31
ACD/KOC (pH 7.4): 3681.61
Polar Surface Area: 87 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 427.2±3.0 cm3

Click to predict properties on the Chemicalize site


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