ChemSpider 2D Image | Dimethyl 5-{[(3-{[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]amino}phenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate | C26H22Cl2N2O7S

Dimethyl 5-{[(3-{[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]amino}phenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate

  • Molecular FormulaC26H22Cl2N2O7S
  • Average mass577.433 Da
  • Monoisotopic mass576.052490 Da
  • ChemSpider ID67122989

  • Double-bond stereo - Double-bond stereo

More details:

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

2,4-Thiophenedicarboxylic acid, 5-[[2-[3-[[(2E)-3-(2,4-dichlorophenyl)-1-oxo-2-propen-1-yl]amino]phenoxy]acetyl]amino]-3-methyl-, dimethyl ester [ACD/Index Name]
5-{[2-(3-{[(2E)-3-(2,4-Dichlorophényl)-2-propenoyl]amino}phénoxy)acétyl]amino}-3-méthyl-2,4-thiophènedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-{[(3-{[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]amino}phenoxy)acetyl]amino}-3-methyl-2,4-thiophenedicarboxylate [ACD/IUPAC Name]
Dimethyl-5-{[(3-{[(2E)-3-(2,4-dichlorphenyl)-2-propenoyl]amino}phenoxy)acetyl]amino}-3-methyl-2,4-thiophendicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 800.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 437.8±34.3 °C
Index of Refraction: 1.668
Molar Refractivity: 148.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.09
ACD/LogD (pH 5.5): 6.13
ACD/BCF (pH 5.5): 27044.43
ACD/KOC (pH 5.5): 51768.55
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 27043.13
ACD/KOC (pH 7.4): 51766.05
Polar Surface Area: 148 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 398.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement