ChemSpider 2D Image | 2-{[3-(2,5-Dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy}-5-[1-(3,4,5-trimethoxyphenyl)-1H-tetrazol-5-yl]aniline | C28H30N6O7

2-{[3-(2,5-Dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy}-5-[1-(3,4,5-trimethoxyphenyl)-1H-tetrazol-5-yl]aniline

  • Molecular FormulaC28H30N6O7
  • Average mass562.574 Da
  • Monoisotopic mass562.217590 Da
  • ChemSpider ID34224051

More details:

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

2-{[3-(2,5-Dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy}-5-[1-(3,4,5-trimethoxyphenyl)-1H-tetrazol-5-yl]anilin [German] [ACD/IUPAC Name]
2-{[3-(2,5-Dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methoxy}-5-[1-(3,4,5-trimethoxyphenyl)-1H-tetrazol-5-yl]aniline [ACD/IUPAC Name]
2-{[3-(2,5-Diméthoxyphényl)-4,5-dihydro-1,2-oxazol-5-yl]méthoxy}-5-[1-(3,4,5-triméthoxyphényl)-1H-tétrazol-5-yl]aniline [French] [ACD/IUPAC Name]
Benzenamine, 2-[[3-(2,5-dimethoxyphenyl)-4,5-dihydro-5-isoxazolyl]methoxy]-5-[1-(3,4,5-trimethoxyphenyl)-1H-tetrazol-5-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 771.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.4±35.7 °C
Index of Refraction: 1.634
Molar Refractivity: 145.7±0.5 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 83.94
ACD/KOC (pH 5.5): 828.29
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 84.36
ACD/KOC (pH 7.4): 832.39
Polar Surface Area: 147 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 407.4±7.0 cm3

Click to predict properties on the Chemicalize site


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