ChemSpider 2D Image | 3-[4-(Dimethylamino)phenyl]-5-(1-naphthyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione | C29H24N4O5

3-[4-(Dimethylamino)phenyl]-5-(1-naphthyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

  • Molecular FormulaC29H24N4O5
  • Average mass508.525 Da
  • Monoisotopic mass508.174683 Da
  • ChemSpider ID3465259

More details:

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

2H-Pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione, 3-[4-(dimethylamino)phenyl]dihydro-5-(1-naphthalenyl)-2-(3-nitrophenyl)- [ACD/Index Name]
3-[4-(Dimethylamino)phenyl]-5-(1-naphthyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazol-4,6(3H,5H)-dion [German] [ACD/IUPAC Name]
3-[4-(Dimethylamino)phenyl]-5-(1-naphthyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione [ACD/IUPAC Name]
3-[4-(Diméthylamino)phényl]-5-(1-naphtyl)-2-(3-nitrophényl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione [French] [ACD/IUPAC Name]
1023807-20-6 [RN]
3-[4-(dimethylamino)phenyl]-5-(naphthalen-1-yl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
3-[4-(dimethylamino)phenyl]-5-naphthalen-1-yl-2-(3-nitrophenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

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

Density: 1.4±0.1 g/cm3
Boiling Point: 769.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.3±35.7 °C
Index of Refraction: 1.705
Molar Refractivity: 142.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1136.44
ACD/KOC (pH 5.5): 5016.85
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1425.00
ACD/KOC (pH 7.4): 6290.70
Polar Surface Area: 99 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 64.6±3.0 dyne/cm
Molar Volume: 365.6±3.0 cm3

Click to predict properties on the Chemicalize site


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