ChemSpider 2D Image | Methyl 4-bromo-2-(diethylamino)-1,3-thiazole-5-carboxylate | C9H13BrN2O2S

Methyl 4-bromo-2-(diethylamino)-1,3-thiazole-5-carboxylate

  • Molecular FormulaC9H13BrN2O2S
  • Average mass293.181 Da
  • Monoisotopic mass291.988098 Da
  • ChemSpider ID21391399

More details:

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

1000575-48-3 [RN]
4-Bromo-2-(diéthylamino)-1,3-thiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 4-bromo-2-(diethylamino)-, methyl ester [ACD/Index Name]
Methyl 4-bromo-2-(diethylamino)-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Methyl-4-brom-2-(diethylamino)-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]
95%
carboxylate [Wiki]
Methyl 4-bromo-2-(diethylamino)thiazole-5-
Methyl 4-bromo-2-(diethylamino)thiazole-5-carboxylate
MFCD09878040

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

Density: 1.5±0.1 g/cm3
Boiling Point: 337.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 157.7±28.7 °C
Index of Refraction: 1.581
Molar Refractivity: 65.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 61.22
ACD/KOC (pH 5.5): 661.75
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 61.23
ACD/KOC (pH 7.4): 661.76
Polar Surface Area: 71 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 197.2±3.0 cm3

Click to predict properties on the Chemicalize site


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