ChemSpider 2D Image | (3E)-4-Ethyl-2-(hydroxyimino)-5-nitro-3-hexenamide | C8H13N3O4

(3E)-4-Ethyl-2-(hydroxyimino)-5-nitro-3-hexenamide

  • Molecular FormulaC8H13N3O4
  • Average mass215.206 Da
  • Monoisotopic mass215.090607 Da
  • ChemSpider ID78434619
  • Double-bond stereo - Double-bond stereo


More details:






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

(2Z,3E)-4-Ethyl-2-(hydroxyimino)-5-nitro-3-hexenamid [German] [ACD/IUPAC Name]
(2Z,3E)-4-Ethyl-2-(hydroxyimino)-5-nitro-3-hexenamide [ACD/IUPAC Name]
(2Z,3E)-4-Éthyl-2-(hydroxyimino)-5-nitro-3-hexénamide [French] [ACD/IUPAC Name]
(3E)-4-Ethyl-2-(hydroxyimino)-5-nitro-3-hexenamide
3-Hexenamide, 4-ethyl-2-(hydroxyimino)-5-nitro-, (2Z,3E)- [ACD/Index Name]
92454-60-9 [RN]
FK409

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

Density: 1.3±0.1 g/cm3
Boiling Point: 428.2±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±6.0 kJ/mol
Flash Point: 212.7±29.3 °C
Index of Refraction: 1.551
Molar Refractivity: 51.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 3.43
ACD/KOC (pH 5.5): 81.67
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.56
Polar Surface Area: 122 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 161.1±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement