ChemSpider 2D Image | (2Z)-7-Methyl-3-oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl 2-furoate | C19H12O5S

(2Z)-7-Methyl-3-oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl 2-furoate

  • Molecular FormulaC19H12O5S
  • Average mass352.361 Da
  • Monoisotopic mass352.040558 Da
  • ChemSpider ID24542689

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-7-Methyl-3-oxo-2-(2-thienylmethylen)-2,3-dihydro-1-benzofuran-6-yl-2-furoat [German] [ACD/IUPAC Name]
(2Z)-7-Methyl-3-oxo-2-(2-thienylmethylene)-2,3-dihydro-1-benzofuran-6-yl 2-furoate [ACD/IUPAC Name]
2-Furancarboxylic acid, (2Z)-2,3-dihydro-7-methyl-3-oxo-2-(2-thienylmethylene)-6-benzofuranyl ester [ACD/Index Name]
2-Furoate de (2Z)-7-méthyl-3-oxo-2-(2-thiénylméthylène)-2,3-dihydro-1-benzofuran-6-yle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 586.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.5±30.1 °C
Index of Refraction: 1.684
Molar Refractivity: 93.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 933.55
ACD/KOC (pH 5.5): 4651.83
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 933.55
ACD/KOC (pH 7.4): 4651.83
Polar Surface Area: 94 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 245.8±3.0 cm3

Click to predict properties on the Chemicalize site


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