Found 53 results

Search term: MF = 'C_{12}H_{9}ClOS_{2}'
ChemSpider 2D Image | (2E)-2-(4-Chlorobenzylidene)-5-(methylsulfanyl)-3(2H)-thiophenone | C12H9ClOS2

(2E)-2-(4-Chlorobenzylidene)-5-(methylsulfanyl)-3(2H)-thiophenone

  • Molecular FormulaC12H9ClOS2
  • Average mass268.782 Da
  • Monoisotopic mass267.978333 Da
  • ChemSpider ID21391196

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-(4-Chlorbenzyliden)-5-(methylsulfanyl)-3(2H)-thiophenon [German] [ACD/IUPAC Name]
(2E)-2-(4-Chlorobenzylidene)-5-(methylsulfanyl)-3(2H)-thiophenone [ACD/IUPAC Name]
(2E)-2-(4-Chlorobenzylidène)-5-(méthylsulfanyl)-3(2H)-thiophénone [French] [ACD/IUPAC Name]
(2E)-2-(4-Chlorobenzylidene)-5-(methylsulfanyl)thiophen-3(2H)-one
3(2H)-Thiophenone, 2-[(4-chlorophenyl)methylene]-5-(methylthio)-, (2E)- [ACD/Index Name]
1000574-38-8 [RN]
2-(4-Chlorobenzylidene)-5-(methylthio)thiophen-
2-(4-Chlorobenzylidene)-5-(methylthio)thiophen-3(2H)-one
3(2H)-one
95%
More...

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

Density: 1.4±0.1 g/cm3
Boiling Point: 446.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 223.9±28.7 °C
Index of Refraction: 1.681
Molar Refractivity: 72.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 571.83
ACD/KOC (pH 5.5): 3275.34
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 571.83
ACD/KOC (pH 7.4): 3275.34
Polar Surface Area: 68 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 57.2±5.0 dyne/cm
Molar Volume: 192.5±5.0 cm3

Click to predict properties on the Chemicalize site


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