ChemSpider 2D Image | 2-Methyl-2-propanyl 3-amino-3-(fluoromethyl)-1-azetidinecarboxylate | C9H17FN2O2

2-Methyl-2-propanyl 3-amino-3-(fluoromethyl)-1-azetidinecarboxylate

  • Molecular FormulaC9H17FN2O2
  • Average mass204.242 Da
  • Monoisotopic mass204.127411 Da
  • ChemSpider ID49577620

More details:

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

1-Azetidinecarboxylic acid, 3-amino-3-(fluoromethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-amino-3-(fluoromethyl)-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-amino-3-(fluormethyl)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-Amino-3-(fluorométhyl)-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1785096-16-3 [RN]
t-Butyl 3-amino-3-(fluoromethyl)azetidine-1-carboxylate
tert-butyl 3-amino-3-(fluoromethyl)azetidine-1-carboxylate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 262.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.0±3.0 kJ/mol
Flash Point: 112.6±23.2 °C
Index of Refraction: 1.468
Molar Refractivity: 50.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.39
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.10
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.10
ACD/KOC (pH 7.4): 35.79
Polar Surface Area: 56 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 35.7±3.0 dyne/cm
Molar Volume: 181.7±3.0 cm3

Click to predict properties on the Chemicalize site


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