ChemSpider 2D Image | MFCD03932961 | C30H32N2O7S

MFCD03932961

  • Molecular FormulaC30H32N2O7S
  • Average mass564.649 Da
  • Monoisotopic mass564.192993 Da
  • ChemSpider ID10843404

More details:

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

2-[3-Hydroxy-4-(2-méthyl-4-propoxybenzoyl)-2-oxo-5-(4-propoxyphényl)-2,5-dihydro-1H-pyrrol-1-yl]-4-méthyl-1,3-thiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-[2,5-dihydro-3-hydroxy-4-(2-methyl-4-propoxybenzoyl)-2-oxo-5-(4-propoxyphenyl)-1H-pyrrol-1-yl]-4-methyl-, methyl ester [ACD/Index Name]
Methyl 2-[3-hydroxy-4-(2-methyl-4-propoxybenzoyl)-2-oxo-5-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Methyl-2-[3-hydroxy-4-(2-methyl-4-propoxybenzoyl)-2-oxo-5-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]
MFCD03932961
519013-02-6 [RN]
methyl 2-(3-hydroxy-4-(2-methyl-4-propoxybenzoyl)-2-oxo-5-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate
methyl 2-{3-hydroxy-4-[(2-methyl-4-propoxyphenyl)carbonyl]-2-oxo-5-(4-propoxyphenyl)(3-pyrrolinyl)}-4-methyl-1,3-thiazole-5-carboxylate
methyl 2-{3-hydroxy-4-[(2-methyl-4-propoxyphenyl)carbonyl]-2-oxo-5-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 710.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 383.7±35.7 °C
Index of Refraction: 1.614
Molar Refractivity: 151.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.59
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 329.85
ACD/KOC (pH 5.5): 1118.45
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 5.69
ACD/KOC (pH 7.4): 19.30
Polar Surface Area: 144 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 435.1±3.0 cm3

Click to predict properties on the Chemicalize site


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