Found 1 result

Search term: 61672247 (Found by CSID)
ChemSpider 2D Image | (3R,6S)-1,7-Dioxaspiro[5.5]undecan-3-ol | C9H16O3

(3R,6S)-1,7-Dioxaspiro[5.5]undecan-3-ol

  • Molecular FormulaC9H16O3
  • Average mass172.221 Da
  • Monoisotopic mass172.109940 Da
  • ChemSpider ID61672247

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,6S)-1,7-Dioxaspiro[5.5]undecan-3-ol [German] [ACD/IUPAC Name]
(3R,6S)-1,7-Dioxaspiro[5.5]undecan-3-ol [ACD/IUPAC Name]
(3R,6S)-1,7-Dioxaspiro[5.5]undécan-3-ol [French] [ACD/IUPAC Name]
1,7-Dioxaspiro[5.5]undecan-3-ol, (3R,6S)- [ACD/Index Name]
(3R,6S)-3-Hydroxy-1,7-dioxaspiro[5.5]undecane
83015-87-6 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 297.5±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.3±6.0 kJ/mol
Flash Point: 133.7±25.9 °C
Index of Refraction: 1.502
Molar Refractivity: 44.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.25
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 3.12
ACD/KOC (pH 5.5): 78.59
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 3.12
ACD/KOC (pH 7.4): 78.59
Polar Surface Area: 39 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 41.3±5.0 dyne/cm
Molar Volume: 151.2±5.0 cm3

Click to predict properties on the Chemicalize site


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