ChemSpider 2D Image | 2,5-Dioxo-1-pyrrolidinyl N-{4-[(E)-(4-azido-3-iodophenyl)diazenyl]benzoyl}-beta-alaninate | C20H17IN7O5

2,5-Dioxo-1-pyrrolidinyl N-{4-[(E)-(4-azido-3-iodophenyl)diazenyl]benzoyl}-β-alaninate

  • Molecular FormulaC20H17IN7O5
  • Average mass561.289 Da
  • Monoisotopic mass561.025757 Da
  • ChemSpider ID2300093
  • Double-bond stereo - Double-bond stereo

More details:

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

2,5-Dioxo-1-pyrrolidinyl N-{4-[(E)-(4-azido-3-iodophenyl)diazenyl]benzoyl}-β-alaninate [ACD/IUPAC Name]
2,5-Dioxo-1-pyrrolidinyl-N-{4-[(E)-(4-azido-3-iodphenyl)diazenyl]benzoyl}-β-alaninat [German] [ACD/IUPAC Name]
N-{4-[(E)-(4-Azido-3-iodophényl)diazényl]benzoyl}-β-alaninate de 2,5-dioxo-1-pyrrolidinyle [French] [ACD/IUPAC Name]
β-Alanine, N-[4-[(E)-2-(4-azido-3-iodophenyl)diazenyl]benzoyl]-, 2,5-dioxo-1-pyrrolidinyl ester [ACD/Index Name]
109545-43-9 [RN]
Benzamide, 4-((4-azido-3-iodophenyl)azo)-N-(3-((2,5-dioxo-1-pyrrolidinyl)oxy)-3-oxopropyl)-
Denny-jaffe reagent

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.49
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.64
ACD/KOC (pH 5.5): 1056.14
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 117.64
ACD/KOC (pH 7.4): 1056.14
Polar Surface Area: 130 Å2
Surface Tension:
Molar Volume:

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