ChemSpider 2D Image | 2-amino-4-formylaminooxy-but-3E-enoic acid | C5H8N2O4

2-amino-4-formylaminooxy-but-3E-enoic acid

  • Molecular FormulaC5H8N2O4
  • Average mass160.128 Da
  • Monoisotopic mass160.048401 Da
  • ChemSpider ID28288253
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:



Featured data source



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

(2S,3E)-2-Amino-4-(formamidooxy)-3-butenoic acid [ACD/IUPAC Name]
(2S,3E)-2-Amino-4-(formamidooxy)-3-butensäure [German] [ACD/IUPAC Name]
2-amino-4-formylaminooxy-but-3E-enoic acid
3-Butenoic acid, 2-amino-4-[(formylamino)oxy]-, (2S,3E)- [ACD/Index Name]
Acide (2S,3E)-2-amino-4-(formamidooxy)-3-buténoïque [French] [ACD/IUPAC Name]
1415602-55-9 [RN]
4-formylaminooxyvinylglycine
germination-arrest factor

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

Density: 1.4±0.1 g/cm3
Boiling Point: 387.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.9±6.0 kJ/mol
Flash Point: 188.4±30.7 °C
Index of Refraction: 1.531
Molar Refractivity: 35.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.04
ACD/LogD (pH 5.5): -3.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 60.4±3.0 dyne/cm
Molar Volume: 115.9±3.0 cm3

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