ChemSpider 2D Image | (1R,2R,3E,5R)-3-(Hydroxyimino)-2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol | C10H17NO2

(1R,2R,3E,5R)-3-(Hydroxyimino)-2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol

  • Molecular FormulaC10H17NO2
  • Average mass183.247 Da
  • Monoisotopic mass183.125931 Da
  • ChemSpider ID30653825

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,2R,3E,5R)-3-(Hydroxyimino)-2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol [German] [ACD/IUPAC Name]
(1R,2R,3E,5R)-3-(Hydroxyimino)-2,6,6-trimethylbicyclo[3.1.1]heptan-2-ol [ACD/IUPAC Name]
(1R,2R,3E,5R)-3-(Hydroxyimino)-2,6,6-triméthylbicyclo[3.1.1]heptan-2-ol [French] [ACD/IUPAC Name]
Bicyclo[3.1.1]heptan-3-one, 2-hydroxy-2,6,6-trimethyl-, oxime, (1R,2R,3E,5R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 299.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.6±6.0 kJ/mol
Flash Point: 180.0±11.9 °C
Index of Refraction: 1.594
Molar Refractivity: 48.8±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.63
ACD/KOC (pH 5.5): 248.99
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.63
ACD/KOC (pH 7.4): 248.98
Polar Surface Area: 53 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 143.9±7.0 cm3

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