ChemSpider 2D Image | (S)-tert-Butyl 3-(3H-imidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxylate | C15H20N4O2

(S)-tert-Butyl 3-(3H-imidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxylate

  • Molecular FormulaC15H20N4O2
  • Average mass288.345 Da
  • Monoisotopic mass288.158630 Da
  • ChemSpider ID28539690

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(3H-Imidazo[4,5-b]pyridin-3-yl)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(S)-tert-Butyl 3-(3H-imidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxylate
1-Pyrrolidinecarboxylic acid, 3-(3H-imidazo[4,5-b]pyridin-3-yl)-, 1,1-dimethylethyl ester, (3S)- [ACD/Index Name]
273757-03-2 [RN]
2-Methyl-2-propanyl (3S)-3-(3H-imidazo[4,5-b]pyridin-3-yl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3S)-3-(3H-imidazo[4,5-b]pyridin-3-yl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
(S)-3-Imidazo[4,5-b]pyridin-3-ylpyrrolidine-1-carboxylic acid tert-butyl ester
(S)-3-Imidazo[4,5-b]pyridin-3-yl-pyrrolidine-1-carboxylic acid tert-butyl ester
(s)-tert-butyl3-(3h-imidazo[4,5-b]pyridin-3-yl)pyrrolidine-1-carboxylate
MFCD22631750 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 445.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 223.5±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 80.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 18.12
ACD/KOC (pH 5.5): 219.49
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 40.38
ACD/KOC (pH 7.4): 489.01
Polar Surface Area: 60 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 47.6±7.0 dyne/cm
Molar Volume: 226.1±7.0 cm3

Click to predict properties on the Chemicalize site


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