ChemSpider 2D Image | (2E)-3-(5-Chloro-2-phenyl-1,3-thiazol-4-yl)acrylic acid | C12H8ClNO2S

(2E)-3-(5-Chloro-2-phenyl-1,3-thiazol-4-yl)acrylic acid

  • Molecular FormulaC12H8ClNO2S
  • Average mass265.715 Da
  • Monoisotopic mass264.996429 Da
  • ChemSpider ID21786203

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(5-Chlor-2-phenyl-1,3-thiazol-4-yl)acrylsäure [German] [ACD/IUPAC Name]
(2E)-3-(5-Chloro-2-phenyl-1,3-thiazol-4-yl)acrylic acid [ACD/IUPAC Name]
2-Propenoic acid, 3-(5-chloro-2-phenyl-4-thiazolyl)-, (2E)- [ACD/Index Name]
Acide (2E)-3-(5-chloro-2-phényl-1,3-thiazol-4-yl)acrylique [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: 471.5±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 238.9±30.9 °C
Index of Refraction: 1.677
Molar Refractivity: 69.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.04
ACD/LogD (pH 7.4): -0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 185.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement