ChemSpider 2D Image | [(9R)-9-(2-Pyridinyl)-6-oxaspiro[4.5]dec-9-yl]acetonitrile | C16H20N2O

[(9R)-9-(2-Pyridinyl)-6-oxaspiro[4.5]dec-9-yl]acetonitrile

  • Molecular FormulaC16H20N2O
  • Average mass256.343 Da
  • Monoisotopic mass256.157562 Da
  • ChemSpider ID32077052

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-2-(9-(Pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl)acetonitrile
[(9R)-9-(2-Pyridinyl)-6-oxaspiro[4.5]dec-9-yl]acetonitril [German] [ACD/IUPAC Name]
[(9R)-9-(2-Pyridinyl)-6-oxaspiro[4.5]dec-9-yl]acetonitrile [ACD/IUPAC Name]
[(9R)-9-(2-Pyridinyl)-6-oxaspiro[4.5]déc-9-yl]acétonitrile [French] [ACD/IUPAC Name]
1401031-38-6 [RN]
6-Oxaspiro[4.5]decane-9-acetonitrile, 9-(2-pyridinyl)-, (9R)- [ACD/Index Name]
(9r)-9-(2-pyridinyl)-6-oxaspiro[4.5]decane-9-acetonitrile
2-[(9R)-9-(pyridin-2-yl)-6-oxaspiro[4.5]decan-9-yl]acetonitrile
2-[(9R)-9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl]acetonitrile
6-Oxaspiro[4.5]decane-9-acetonitrile,9-(2-pyridinyl)-,(9R)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 445.3±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.3±3.0 kJ/mol
    Flash Point: 223.1±23.2 °C
    Index of Refraction: 1.559
    Molar Refractivity: 73.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.75
    ACD/LogD (pH 5.5): 2.39
    ACD/BCF (pH 5.5): 33.42
    ACD/KOC (pH 5.5): 362.96
    ACD/LogD (pH 7.4): 2.64
    ACD/BCF (pH 7.4): 59.63
    ACD/KOC (pH 7.4): 647.49
    Polar Surface Area: 46 Å2
    Polarizability: 29.0±0.5 10-24cm3
    Surface Tension: 50.3±5.0 dyne/cm
    Molar Volume: 226.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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