ChemSpider 2D Image | N-{[5-Chloro-2-(propylsulfanyl)-4-pyrimidinyl]carbonyl}glycine | C10H12ClN3O3S

N-{[5-Chloro-2-(propylsulfanyl)-4-pyrimidinyl]carbonyl}glycine

  • Molecular FormulaC10H12ClN3O3S
  • Average mass289.739 Da
  • Monoisotopic mass289.028778 Da
  • ChemSpider ID24793633

More details:

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

Glycine, N-[[5-chloro-2-(propylthio)-4-pyrimidinyl]carbonyl]- [ACD/Index Name]
N-{[5-Chlor-2-(propylsulfanyl)-4-pyrimidinyl]carbonyl}glycin [German] [ACD/IUPAC Name]
N-{[5-Chloro-2-(propylsulfanyl)-4-pyrimidinyl]carbonyl}glycine [ACD/IUPAC Name]
N-{[5-Chloro-2-(propylsulfanyl)-4-pyrimidinyl]carbonyl}glycine [French] [ACD/IUPAC Name]
2-[(5-chloro-2-propylthiopyrimidin-4-yl)carbonylamino]acetic acid
N-{[5-chloro-2-(propylthio)pyrimidin-4-yl]carbonyl}glycine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 543.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 282.7±28.7 °C
Index of Refraction: 1.606
Molar Refractivity: 68.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 72.3±5.0 dyne/cm
Molar Volume: 198.4±5.0 cm3

Click to predict properties on the Chemicalize site


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