ChemSpider 2D Image | 3,4,8-Trimethyl-2-oxo-2H-chromen-7-yl 2-thiophenecarboxylate | C17H14O4S

3,4,8-Trimethyl-2-oxo-2H-chromen-7-yl 2-thiophenecarboxylate

  • Molecular FormulaC17H14O4S
  • Average mass314.356 Da
  • Monoisotopic mass314.061279 Da
  • ChemSpider ID21750021

More details:

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

2-Thiophènecarboxylate de 3,4,8-triméthyl-2-oxo-2H-chromén-7-yle [French] [ACD/IUPAC Name]
2-Thiophenecarboxylic acid, 3,4,8-trimethyl-2-oxo-2H-1-benzopyran-7-yl ester [ACD/Index Name]
3,4,8-Trimethyl-2-oxo-2H-chromen-7-yl 2-thiophenecarboxylate [ACD/IUPAC Name]
3,4,8-Trimethyl-2-oxo-2H-chromen-7-yl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
(3,4,8-trimethyl-2-oxochromen-7-yl) thiophene-2-carboxylate
3,4,8-trimethyl-2-oxo-2H-chromen-7-yl thiophene-2-carboxylate
3,4,8-trimethyl-2-oxochromen-7-yl thiophene-2-carboxylate
446279-78-3 [RN]
MFCD03029912
Thiophene-2-carboxylic acid 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl ester

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 516.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.8±3.0 kJ/mol
    Flash Point: 265.9±30.1 °C
    Index of Refraction: 1.610
    Molar Refractivity: 84.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.45
    ACD/LogD (pH 5.5): 4.24
    ACD/BCF (pH 5.5): 985.05
    ACD/KOC (pH 5.5): 4834.11
    ACD/LogD (pH 7.4): 4.24
    ACD/BCF (pH 7.4): 985.05
    ACD/KOC (pH 7.4): 4834.11
    Polar Surface Area: 81 Å2
    Polarizability: 33.3±0.5 10-24cm3
    Surface Tension: 48.4±3.0 dyne/cm
    Molar Volume: 242.2±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement