ChemSpider 2D Image | tert-butyl 3-(4-amino-1H-pyrazol-1-yl)azetidine-1-carboxylate | C11H18N4O2

tert-butyl 3-(4-amino-1H-pyrazol-1-yl)azetidine-1-carboxylate

  • Molecular FormulaC11H18N4O2
  • Average mass238.286 Da
  • Monoisotopic mass238.142975 Da
  • ChemSpider ID22568256

More details:






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

1-Azetidinecarboxylic acid, 3-(4-amino-1H-pyrazol-1-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(4-amino-1H-pyrazol-1-yl)-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(4-amino-1H-pyrazol-1-yl)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-(4-Amino-1H-pyrazol-1-yl)-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-butyl 3-(4-amino-1H-pyrazol-1-yl)azetidine-1-carboxylate
1-(3-Methoxypropyl)urea [ACD/IUPAC Name]
1029413-51-1 [RN]
1-boc-3-(4-amino-1-pyrazolyl)azetidine
3-(4-Amino-pyrazol-1-yl)-azetidine-1-carboxylic acid tert-butyl ester
4-Amino-1-(1-Boc-azetidin-3-yl)-1H-pyrazole
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 399.5±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 195.4±25.1 °C
Index of Refraction: 1.610
Molar Refractivity: 63.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.86
ACD/KOC (pH 5.5): 53.73
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.93
ACD/KOC (pH 7.4): 55.72
Polar Surface Area: 73 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 48.8±7.0 dyne/cm
Molar Volume: 182.3±7.0 cm3

Click to predict properties on the Chemicalize site






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