ChemSpider 2D Image | (2S)-2-[(E)-(2-Methoxy-4-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide | C18H18N4O6

(2S)-2-[(E)-(2-Methoxy-4-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide

  • Molecular FormulaC18H18N4O6
  • Average mass386.359 Da
  • Monoisotopic mass386.122620 Da
  • ChemSpider ID34987626

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-[(E)-(2-Methoxy-4-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamid [German] [ACD/IUPAC Name]
(2S)-2-[(E)-(2-Methoxy-4-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxobutanamide [ACD/IUPAC Name]
(2S)-2-[(E)-(2-Méthoxy-4-nitrophényl)diazényl]-N-(2-méthoxyphényl)-3-oxobutanamide [French] [ACD/IUPAC Name]
Butanamide, 2-[(E)-2-(2-methoxy-4-nitrophenyl)diazenyl]-N-(2-methoxyphenyl)-3-oxo-, (2S)- [ACD/Index Name]
228-768-4 [EINECS]
6358-31-2 [RN]
Pigment Yellow 74
UNII-85338B499O

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

Density: 1.3±0.1 g/cm3
Boiling Point: 577.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.9±30.1 °C
Index of Refraction: 1.600
Molar Refractivity: 99.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 55.53
ACD/KOC (pH 5.5): 375.92
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 1.84
ACD/KOC (pH 7.4): 12.43
Polar Surface Area: 135 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 289.6±7.0 cm3

Click to predict properties on the Chemicalize site


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