ChemSpider 2D Image | Ethyl 2-(chloromethyl)-1,3-thiazole-4-carboxylate | C7H8ClNO2S

Ethyl 2-(chloromethyl)-1,3-thiazole-4-carboxylate

  • Molecular FormulaC7H8ClNO2S
  • Average mass205.662 Da
  • Monoisotopic mass204.996429 Da
  • ChemSpider ID21542697

More details:

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

2-(Chlorométhyl)-1,3-thiazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
2-(Chloromethyl)-1,3-thiazole-4-carboxylic acid ethyl ester
2-(Chloromethyl)-4-thiazolecarboxylic acid ethyl ester
2-(Chloromethyl)thiazole-4-carboxylic acid ethyl ester
4-Thiazolecarboxylic acid, 2-(chloromethyl)-, ethyl ester [ACD/Index Name]
842130-48-7 [RN]
Ethyl 2-(chloromethyl)-1,3-thiazole-4-carboxylate [ACD/IUPAC Name]
Ethyl 2-(chloromethyl-4-)thiazolecarboxylate
Ethyl-2-(chlormethyl)-1,3-thiazol-4-carboxylat [German] [ACD/IUPAC Name]
Ethyl-2-(chloromethyl)-1,3-thiazole-4-carboxylate [German]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 276.8±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.5±3.0 kJ/mol
    Flash Point: 121.2±21.8 °C
    Index of Refraction: 1.547
    Molar Refractivity: 48.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.84
    ACD/LogD (pH 5.5): 1.89
    ACD/BCF (pH 5.5): 16.13
    ACD/KOC (pH 5.5): 254.71
    ACD/LogD (pH 7.4): 1.89
    ACD/BCF (pH 7.4): 16.13
    ACD/KOC (pH 7.4): 254.71
    Polar Surface Area: 67 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 47.3±3.0 dyne/cm
    Molar Volume: 154.2±3.0 cm3

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