ChemSpider 2D Image | 2-Methyl-2-propanyl 3-(chloromethyl)-2-thiophenecarboxylate | C10H13ClO2S

2-Methyl-2-propanyl 3-(chloromethyl)-2-thiophenecarboxylate

  • Molecular FormulaC10H13ClO2S
  • Average mass232.727 Da
  • Monoisotopic mass232.032471 Da
  • ChemSpider ID29737729

More details:

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

2-Methyl-2-propanyl 3-(chloromethyl)-2-thiophenecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(chlormethyl)-2-thiophencarboxylat [German] [ACD/IUPAC Name]
2-Thiophenecarboxylic acid, 3-(chloromethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
3-(Chlorométhyl)-2-thiophènecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1338565-38-0 [RN]
MFCD27922688
tert-Butyl 3-(chloromethyl)thiophene-2-carboxylate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 325.6±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.8±3.0 kJ/mol
    Flash Point: 150.7±25.1 °C
    Index of Refraction: 1.531
    Molar Refractivity: 60.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.30
    ACD/LogD (pH 5.5): 3.45
    ACD/BCF (pH 5.5): 244.72
    ACD/KOC (pH 5.5): 1784.09
    ACD/LogD (pH 7.4): 3.45
    ACD/BCF (pH 7.4): 244.72
    ACD/KOC (pH 7.4): 1784.09
    Polar Surface Area: 55 Å2
    Polarizability: 23.8±0.5 10-24cm3
    Surface Tension: 39.0±3.0 dyne/cm
    Molar Volume: 194.1±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement