ChemSpider 2D Image | (3Z,5S)-5-sec-Butyl-3-{1-[2-(2,4-dinitrophenyl)hydrazino]ethylidene}-2,4-pyrrolidinedione | C16H19N5O6

(3Z,5S)-5-sec-Butyl-3-{1-[2-(2,4-dinitrophenyl)hydrazino]ethylidene}-2,4-pyrrolidinedione

  • Molecular FormulaC16H19N5O6
  • Average mass377.352 Da
  • Monoisotopic mass377.133545 Da
  • ChemSpider ID24742112

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3Z,5S)-5-sec-Butyl-3-{1-[2-(2,4-dinitrophenyl)hydrazino]ethyliden}-2,4-pyrrolidindion [German] [ACD/IUPAC Name]
(3Z,5S)-5-sec-Butyl-3-{1-[2-(2,4-dinitrophenyl)hydrazino]ethylidene}-2,4-pyrrolidinedione [ACD/IUPAC Name]
(3Z,5S)-5-sec-Butyl-3-{1-[2-(2,4-dinitrophényl)hydrazino]éthylidène}-2,4-pyrrolidinedione [French] [ACD/IUPAC Name]
2,4-Pyrrolidinedione, 3-[1-[2-(2,4-dinitrophenyl)hydrazinyl]ethylidene]-5-(1-methylpropyl)-, (3Z,5S)- [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: 524.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 270.7±30.1 °C
Index of Refraction: 1.629
Molar Refractivity: 95.3±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 19.92
ACD/KOC (pH 5.5): 296.27
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 19.88
ACD/KOC (pH 7.4): 295.65
Polar Surface Area: 162 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 64.6±3.0 dyne/cm
Molar Volume: 268.1±3.0 cm3

Click to predict properties on the Chemicalize site


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