ChemSpider 2D Image | 2-Methyl-2-propanyl 3-bromo-1-azetidinecarboxylate | C8H14BrNO2

2-Methyl-2-propanyl 3-bromo-1-azetidinecarboxylate

  • Molecular FormulaC8H14BrNO2
  • Average mass236.106 Da
  • Monoisotopic mass235.020782 Da
  • ChemSpider ID26549295

More details:






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

1-Azetidinecarboxylic acid, 3-bromo-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-bromo-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-brom-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-Bromo-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(S)-Methyl 4-amino-2-((tert-butoxycarbonyl)amino)-4-oxobutanoate
[1064194-10-0]
1041026-70-3 [RN]
1064194-10-0 [RN]
1-Boc-3-bromo-azetidine
1-BOC-3-Bromoazetidine
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 257.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.5±3.0 kJ/mol
Flash Point: 109.7±25.4 °C
Index of Refraction: 1.523
Molar Refractivity: 50.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 18.57
ACD/KOC (pH 5.5): 281.77
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 18.57
ACD/KOC (pH 7.4): 281.77
Polar Surface Area: 30 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 163.6±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement