ChemSpider 2D Image | (2Z,3Z)-2-Benzylidene-3-(methoxycarbonyl)-4-phenyl-3-butenoic acid | C19H16O4

(2Z,3Z)-2-Benzylidene-3-(methoxycarbonyl)-4-phenyl-3-butenoic acid

  • Molecular FormulaC19H16O4
  • Average mass308.328 Da
  • Monoisotopic mass308.104858 Da
  • ChemSpider ID62250210
  • Double-bond stereo - Double-bond stereo


More details:






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

(2Z,3Z)-2-Benzyliden-3-(methoxycarbonyl)-4-phenyl-3-butensäure [German] [ACD/IUPAC Name]
(2Z,3Z)-2-Benzylidene-3-(methoxycarbonyl)-4-phenyl-3-butenoic acid [ACD/IUPAC Name]
Acide (2Z,3Z)-2-benzylidène-3-(méthoxycarbonyl)-4-phényl-3-buténoïque [French] [ACD/IUPAC Name]
Butanedioic acid, 2,3-bis(phenylmethylene)-, monomethyl ester, (2Z,3Z)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 511.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 185.6±23.6 °C
Index of Refraction: 1.650
Molar Refractivity: 89.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 1.40
ACD/KOC (pH 5.5): 10.01
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 53.6±3.0 dyne/cm
Molar Volume: 246.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement