ChemSpider 2D Image | 7-(chloromethyl)-2,3-dimethyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one | C9H9ClN2OS

7-(chloromethyl)-2,3-dimethyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one

  • Molecular FormulaC9H9ClN2OS
  • Average mass228.699 Da
  • Monoisotopic mass228.012405 Da
  • ChemSpider ID21329935

More details:

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

100003-82-5 [RN]
5H-Thiazolo[3,2-a]pyrimidin-5-one, 7-(chloromethyl)-2,3-dimethyl- [ACD/Index Name]
7-(Chlormethyl)-2,3-dimethyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-on [German] [ACD/IUPAC Name]
7-(chloromethyl)-2,3-dimethyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-(Chloromethyl)-2,3-dimethyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one [ACD/IUPAC Name]
7-(Chlorométhyl)-2,3-diméthyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one [French] [ACD/IUPAC Name]
7-(chloromethyl)-2,3-dimethyl-4-hydro-1,3-thiazolino[3,2-a]pyrimidin-5-one
7-(Chloromethyl)-2,3-dimethyl-5H-[1,3]thiazolo-[3,2-a]pyrimidin-5-one
7-(Chloromethyl)-2,3-dimethyl-5H-thiazolo[3,2-a]pyrimidin-5-one
7-Chloromethyl-2,3-dimethyl-thiazolo[3,2-a]pyrimidin-5-one

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

MFCD09971919 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 340.2±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.4±3.0 kJ/mol
    Flash Point: 159.5±28.4 °C
    Index of Refraction: 1.682
    Molar Refractivity: 58.8±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.70
    ACD/LogD (pH 5.5): 1.55
    ACD/BCF (pH 5.5): 8.93
    ACD/KOC (pH 5.5): 166.86
    ACD/LogD (pH 7.4): 1.55
    ACD/BCF (pH 7.4): 8.93
    ACD/KOC (pH 7.4): 166.86
    Polar Surface Area: 58 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 51.0±7.0 dyne/cm
    Molar Volume: 155.3±7.0 cm3

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