ChemSpider 2D Image | (1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N'-bis[2-bromo(~2~H_4_)ethyl]phosphorodiamidate | C9H8D8Br2N5O4P

(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N'-bis[2-bromo(2H4)ethyl]phosphorodiamidate

  • Molecular FormulaC9H8D8Br2N5O4P
  • Average mass457.086 Da
  • Monoisotopic mass454.980865 Da
  • ChemSpider ID58794378

  • Non-standard isotope - Non-standard isotope

More details:

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

(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl N,N'-bis[2-bromo(2H4)ethyl]phosphorodiamidate [ACD/IUPAC Name]
(1-Methyl-2-nitro-1H-imidazol-5-yl)methyl-N,N'-bis[2-brom(2H4)ethyl]phosphorodiamidat [German] [ACD/IUPAC Name]
N,N'-Bis[2-bromo(2H4)éthyl]phosphorodiamidate de (1-méthyl-2-nitro-1H-imidazol-5-yl)méthyle [French] [ACD/IUPAC Name]
Phosphorodiamidic acid, N,N'-bis(2-bromoethyl-1,1,2,2-d4)-, (1-methyl-2-nitro-1H-imidazol-5-yl)methyl ester [ACD/Index Name]
918632-75-4 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 565.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.7±32.9 °C
Index of Refraction: 1.662
Molar Refractivity: 84.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: -0.40
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.17
ACD/KOC (pH 5.5): 38.99
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.17
ACD/KOC (pH 7.4): 38.99
Polar Surface Area: 124 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 71.5±7.0 dyne/cm
Molar Volume: 227.8±7.0 cm3

Click to predict properties on the Chemicalize site


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