ChemSpider 2D Image | MFCD00795962 | C7H10O

MFCD00795962

  • Molecular FormulaC7H10O
  • Average mass110.154 Da
  • Monoisotopic mass110.073166 Da
  • ChemSpider ID21500030

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2R)-2-Ethinylcyclopentanol [German] [ACD/IUPAC Name]
(1S,2R)-2-Ethynylcyclopentanol [ACD/IUPAC Name]
(1S,2R)-2-Éthynylcyclopentanol [French] [ACD/IUPAC Name]
2-ethynyl-Cyclopentanol
Cyclopentanol, 2-ethynyl-, (1S,2R)- [ACD/Index Name]
MFCD00795962
22022-30-6 [RN]
2-Ethynylcyclopentanol [ACD/IUPAC Name]
61967-50-8 [RN]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 161.9±29.0 °C at 760 mmHg
    Vapour Pressure: 0.8±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 46.4±6.0 kJ/mol
    Flash Point: 62.4±17.3 °C
    Index of Refraction: 1.492
    Molar Refractivity: 31.7±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.71
    ACD/LogD (pH 5.5): 0.93
    ACD/BCF (pH 5.5): 3.02
    ACD/KOC (pH 5.5): 76.72
    ACD/LogD (pH 7.4): 0.93
    ACD/BCF (pH 7.4): 3.02
    ACD/KOC (pH 7.4): 76.72
    Polar Surface Area: 20 Å2
    Polarizability: 12.6±0.5 10-24cm3
    Surface Tension: 39.1±5.0 dyne/cm
    Molar Volume: 109.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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