ChemSpider 2D Image | 2-[(Isopropylcarbamoyl)amino]malonamide | C7H14N4O3

2-[(Isopropylcarbamoyl)amino]malonamide

  • Molecular FormulaC7H14N4O3
  • Average mass202.211 Da
  • Monoisotopic mass202.106583 Da
  • ChemSpider ID29975165

More details:

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

2-[(Isopropylcarbamoyl)amino]malonamid [German] [ACD/IUPAC Name]
2-[(Isopropylcarbamoyl)amino]malonamide [ACD/IUPAC Name]
2-[(Isopropylcarbamoyl)amino]malonamide [French] [ACD/IUPAC Name]
Propanediamide, 2-[[[(1-methylethyl)amino]carbonyl]amino]- [ACD/Index Name]
2-[(ISOPROPYLCARBAMOYL)AMINO]PROPANEDIAMIDE
2-{[(PROPAN-2-YL)CARBAMOYL]AMINO}PROPANEDIAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 533.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 276.7±28.7 °C
Index of Refraction: 1.517
Molar Refractivity: 48.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.73
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.02
ACD/LogD (pH 7.4): -1.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.79
Polar Surface Area: 127 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 161.2±3.0 cm3

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