ChemSpider 2D Image | (R)-tert-Butyl 3-((2-chloropyrimidin-4-yl)oxy)pyrrolidine-1-carboxylate | C13H18ClN3O3

(R)-tert-Butyl 3-((2-chloropyrimidin-4-yl)oxy)pyrrolidine-1-carboxylate

  • Molecular FormulaC13H18ClN3O3
  • Average mass299.753 Da
  • Monoisotopic mass299.103668 Da
  • ChemSpider ID27729759

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-[(2-Chloro-4-pyrimidinyl)oxy]-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(R)-tert-Butyl 3-((2-chloropyrimidin-4-yl)oxy)pyrrolidine-1-carboxylate
1264036-68-1 [RN]
1-Pyrrolidinecarboxylic acid, 3-[(2-chloro-4-pyrimidinyl)oxy]-, 1,1-dimethylethyl ester, (3R)- [ACD/Index Name]
2-Methyl-2-propanyl (3R)-3-[(2-chloro-4-pyrimidinyl)oxy]-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3R)-3-[(2-chlor-4-pyrimidinyl)oxy]-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
(R)-1-Boc-3-(2-Chloropyrimidin-4-yloxy)pyrrolidine
(R)-3-(2-Chloropyrimidin-4-yloxy)pyrrolidine-1-carboxylic acid tert-butyl ester
(R)-3-(2-Chloro-pyrimidin-4-yloxy)-pyrrolidine-1-carboxylic acid tert-butyl ester
(R)-tert-butyl 3-(2-chloropyrimidin-4-yloxy)pyrrolidine-1-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 437.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.4±3.0 kJ/mol
    Flash Point: 218.3±25.9 °C
    Index of Refraction: 1.545
    Molar Refractivity: 74.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.65
    ACD/LogD (pH 5.5): 2.04
    ACD/BCF (pH 5.5): 20.78
    ACD/KOC (pH 5.5): 305.33
    ACD/LogD (pH 7.4): 2.04
    ACD/BCF (pH 7.4): 20.78
    ACD/KOC (pH 7.4): 305.33
    Polar Surface Area: 65 Å2
    Polarizability: 29.4±0.5 10-24cm3
    Surface Tension: 51.6±3.0 dyne/cm
    Molar Volume: 234.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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