ChemSpider 2D Image | 1,2,3,4-Tetrahydro-4-oxo-2-thioxo-5-pyrimidinecarbonyl chloride | C5H3ClN2O2S

1,2,3,4-Tetrahydro-4-oxo-2-thioxo-5-pyrimidinecarbonyl chloride

  • Molecular FormulaC5H3ClN2O2S
  • Average mass190.607 Da
  • Monoisotopic mass189.960373 Da
  • ChemSpider ID103874421

More details:

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

1,2,3,4-Tetrahydro-4-oxo-2-thioxo-5-pyrimidinecarbonyl chloride
3346-65-4 [RN]
4-Oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidincarbonylchlorid [German] [ACD/IUPAC Name]
4-Oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonyl chloride [ACD/IUPAC Name]
5-Pyrimidinecarbonyl chloride, 1,2,3,4-tetrahydro-4-oxo-2-thioxo- [ACD/Index Name]
Chlorure de 4-oxo-2-thioxo-1,2,3,4-tétrahydro-5-pyrimidinecarbonyle [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.673
Molar Refractivity: 42.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.28
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.76
ACD/LogD (pH 7.4): -0.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.55
Polar Surface Area: 90 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 79.5±5.0 dyne/cm
Molar Volume: 112.8±5.0 cm3

Click to predict properties on the Chemicalize site


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