ChemSpider 2D Image | 2-Methyl-2-propanyl (2E)-4-bromo-2-butenoate | C8H13BrO2

2-Methyl-2-propanyl (2E)-4-bromo-2-butenoate

  • Molecular FormulaC8H13BrO2
  • Average mass221.092 Da
  • Monoisotopic mass220.009888 Da
  • ChemSpider ID60598415

More details:

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

(2E)-4-Bromo-2-buténoate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 4-bromo-, 1,1-dimethylethyl ester, (2E)- [ACD/Index Name]
2-Methyl-2-propanyl (2E)-4-bromo-2-butenoate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2E)-4-brom-2-butenoat [German] [ACD/IUPAC Name]
(E)-tert-Butyl 4-bromobut-2-enoate
50745-65-8 [RN]
86606-04-4 [RN]
MFCD20484020
tert-butyl (2E)-4-bromobut-2-enoate
tert-Butyl 4-bromobut-2-enoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 229.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.6±3.0 kJ/mol
Flash Point: 92.5±22.6 °C
Index of Refraction: 1.481
Molar Refractivity: 48.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.67
ACD/KOC (pH 5.5): 657.49
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.67
ACD/KOC (pH 7.4): 657.49
Polar Surface Area: 26 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 170.9±3.0 cm3

Click to predict properties on the Chemicalize site


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