ChemSpider 2D Image | 4-[(4-{[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methoxy}-3-nitrophenyl)sulfonyl]morpholine | C17H22N4O7S

4-[(4-{[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methoxy}-3-nitrophenyl)sulfonyl]morpholine

  • Molecular FormulaC17H22N4O7S
  • Average mass426.444 Da
  • Monoisotopic mass426.120911 Da
  • ChemSpider ID21972791

More details:

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

4-[(4-{[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methoxy}-3-nitrophenyl)sulfonyl]morpholin [German] [ACD/IUPAC Name]
4-[(4-{[3-(2-Methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methoxy}-3-nitrophenyl)sulfonyl]morpholine [ACD/IUPAC Name]
4-[(4-{[3-(2-Méthyl-2-propanyl)-1,2,4-oxadiazol-5-yl]méthoxy}-3-nitrophényl)sulfonyl]morpholine [French] [ACD/IUPAC Name]
Morpholine, 4-[[4-[[3-(1,1-dimethylethyl)-1,2,4-oxadiazol-5-yl]methoxy]-3-nitrophenyl]sulfonyl]- [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: 625.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.3±34.3 °C
Index of Refraction: 1.572
Molar Refractivity: 101.4±0.4 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.74
ACD/KOC (pH 5.5): 422.77
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 32.74
ACD/KOC (pH 7.4): 422.77
Polar Surface Area: 149 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 308.3±3.0 cm3

Click to predict properties on the Chemicalize site


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