Found 53 results

Search term: MF = 'C_{21}H_{19}NO_{7}S_{2}'
ChemSpider 2D Image | 6-{(E)-[3-(2,4-Dimethoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2,3-dimethoxybenzoic acid | C21H19NO7S2

6-{(E)-[3-(2,4-Dimethoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2,3-dimethoxybenzoic acid

  • Molecular FormulaC21H19NO7S2
  • Average mass461.508 Da
  • Monoisotopic mass461.060303 Da
  • ChemSpider ID23471107

  • Double-bond stereo - Double-bond stereo

More details:

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

6-{(E)-[3-(2,4-Dimethoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-yliden]methyl}-2,3-dimethoxybenzoesäure [German] [ACD/IUPAC Name]
6-{(E)-[3-(2,4-Dimethoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2,3-dimethoxybenzoic acid [ACD/IUPAC Name]
Acide 6-{(E)-[3-(2,4-diméthoxyphényl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidène]méthyl}-2,3-diméthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 6-[(E)-[3-(2,4-dimethoxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-2,3-dimethoxy- [ACD/Index 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: 661.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.3±3.0 kJ/mol
Flash Point: 353.9±34.3 °C
Index of Refraction: 1.690
Molar Refractivity: 118.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.57
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.67
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.22
Polar Surface Area: 152 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 76.8±5.0 dyne/cm
Molar Volume: 310.0±5.0 cm3

Click to predict properties on the Chemicalize site


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