ChemSpider 2D Image | Ethyl 2-(2-bromo-1,3-thiazol-4-yl)-4-oxobutanoate | C9H10BrNO3S

Ethyl 2-(2-bromo-1,3-thiazol-4-yl)-4-oxobutanoate

  • Molecular FormulaC9H10BrNO3S
  • Average mass292.150 Da
  • Monoisotopic mass290.956482 Da
  • ChemSpider ID24218086

More details:

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

2-(2-Bromo-1,3-thiazol-4-yl)-4-oxobutanoate d'éthyle [French] [ACD/IUPAC Name]
4-Thiazoleacetic acid, 2-bromo-α-(2-oxoethyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-(2-bromo-1,3-thiazol-4-yl)-4-oxobutanoate [ACD/IUPAC Name]
Ethyl-2-(2-brom-1,3-thiazol-4-yl)-4-oxobutanoat [German] [ACD/IUPAC Name]
4-THIAZOLEACETIC ACID 2-BROMO-A-(2-OXOETHYL)-,ETHYL ESTER
4-Thiazoleacetic acid, 2-bromo--α--(2-oxoethyl)-, ethyl ester (9CI)
4-thiazoleacetic acid,2-bromo-a-(2-oxoethyl)-,ethyl ester
691877-08-4 [RN]
ethyl 2-(2-bromothiazol-4-yl)-4-oxobutanoate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 359.4±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 171.1±25.1 °C
Index of Refraction: 1.554
Molar Refractivity: 60.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.41
ACD/KOC (pH 5.5): 246.52
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.41
ACD/KOC (pH 7.4): 246.52
Polar Surface Area: 85 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 188.7±3.0 cm3

Click to predict properties on the Chemicalize site


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