Found 33 results

Search term: MF = 'C_{19}H_{14}Br_{2}N_{2}O_{5}S'
ChemSpider 2D Image | 4-{(E)-[(5Z)-5-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid | C19H14Br2N2O5S

4-{(E)-[(5Z)-5-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid

  • Molecular FormulaC19H14Br2N2O5S
  • Average mass542.198 Da
  • Monoisotopic mass539.898987 Da
  • ChemSpider ID12979895

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{(E)-[(5Z)-5-(2,3-Dibrom-4-hydroxy-5-methoxybenzyliden)-3-methyl-4-oxo-1,3-thiazolidin-2-yliden]amino}benzoesäure [German] [ACD/IUPAC Name]
4-{(E)-[(5Z)-5-(2,3-Dibromo-4-hydroxy-5-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid [ACD/IUPAC Name]
Acide 4-{(E)-[(5Z)-5-(2,3-dibromo-4-hydroxy-5-méthoxybenzylidène)-3-méthyl-4-oxo-1,3-thiazolidin-2-ylidène]amino}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(2E,5Z)-5-[(2,3-dibromo-4-hydroxy-5-methoxyphenyl)methylene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 645.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 344.2±34.3 °C
Index of Refraction: 1.701
Molar Refractivity: 116.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 6.16
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 214.28
ACD/KOC (pH 5.5): 708.17
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.31
Polar Surface Area: 125 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 301.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement