ChemSpider 2D Image | (5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 2-[(~2~H_5_)ethyloxy]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-1H-benzimidazole-7-carboxylate | C30H19D5N4O8

(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 2-[(2H5)ethyloxy]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-1H-benzimidazole-7-carboxylate

  • Molecular FormulaC30H19D5N4O8
  • Average mass573.564 Da
  • Monoisotopic mass573.190796 Da
  • ChemSpider ID58779015

  • Non-standard isotope - Non-standard isotope

More details:

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

(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 2-[(2H5)ethyloxy]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-1H-benzimidazole-7-carboxylate [ACD/IUPAC Name]
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl-2-[(2H5)ethyloxy]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-1H-benzimidazol-7-carboxylat [German] [ACD/IUPAC Name]
1H-Benzimidazole-7-carboxylic acid, 1-[[2'-(4,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl)[1,1'-biphenyl]-4-yl]methyl]-2-(ethyl-d5-oxy)-, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester [ACD/Index Name]
2-[(2H5)Éthyloxy]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphénylyl]méthyl}-1H-benzimidazole-7-carboxylate de (5-méthyl-2-oxo-1,3-dioxol-4-yl)méthyle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.680
Molar Refractivity: 147.8±0.5 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.73
ACD/LogD (pH 5.5): 4.54
ACD/BCF (pH 5.5): 1625.67
ACD/KOC (pH 5.5): 6787.55
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 499.16
ACD/KOC (pH 7.4): 2084.11
Polar Surface Area: 140 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 57.2±7.0 dyne/cm
Molar Volume: 391.0±7.0 cm3

Click to predict properties on the Chemicalize site


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