ChemSpider 2D Image | 1-{(1S)-2-Chloro-1-[(1,3-dichloro-2-propanyl)oxy]ethyl}-2,4(1H,3H)-pyrimidinedione | C9H11Cl3N2O3

1-{(1S)-2-Chloro-1-[(1,3-dichloro-2-propanyl)oxy]ethyl}-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H11Cl3N2O3
  • Average mass301.554 Da
  • Monoisotopic mass299.983521 Da
  • ChemSpider ID68026799

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-{(1S)-2-Chlor-1-[(1,3-dichlor-2-propanyl)oxy]ethyl}-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{(1S)-2-Chloro-1-[(1,3-dichloro-2-propanyl)oxy]ethyl}-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{(1S)-2-Chloro-1-[(1,3-dichloro-2-propanyl)oxy]éthyl}-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(1S)-2-chloro-1-[2-chloro-1-(chloromethyl)ethoxy]ethyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.540
Molar Refractivity: 64.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.29
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.88
ACD/KOC (pH 5.5): 152.55
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.76
ACD/KOC (pH 7.4): 150.12
Polar Surface Area: 59 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 205.9±3.0 cm3

Click to predict properties on the Chemicalize site


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