ChemSpider 2D Image | (1S,2S)-2-[4-(2-Methyl-2-propanyl)phenoxy]cyclohexanol | C16H24O2

(1S,2S)-2-[4-(2-Methyl-2-propanyl)phenoxy]cyclohexanol

  • Molecular FormulaC16H24O2
  • Average mass248.361 Da
  • Monoisotopic mass248.177628 Da
  • ChemSpider ID30782666

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2S)-2-[4-(2-Methyl-2-propanyl)phenoxy]cyclohexanol [German] [ACD/IUPAC Name]
(1S,2S)-2-[4-(2-Methyl-2-propanyl)phenoxy]cyclohexanol [ACD/IUPAC Name]
(1S,2S)-2-[4-(2-Méthyl-2-propanyl)phénoxy]cyclohexanol [French] [ACD/IUPAC Name]
Cyclohexanol, 2-[4-(1,1-dimethylethyl)phenoxy]-, (1S,2S)- [ACD/Index Name]
(1R,2R)-2-(4-tert-butylphenoxy)-1-cyclohexanol
(1R,2R)-2-(4-tert-butylphenoxy)cyclohexan-1-ol
(1S,2S)-2-(4-tert-butylphenoxy)cyclohexan-1-ol
(1S-Trans)-2-(4-tert-butylphenoxy)cyclohexanol
[169527-71-3] [RN]
169265-76-3 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

UNII-D498ND4OQG [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 365.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 150.7±22.1 °C
Index of Refraction: 1.529
Molar Refractivity: 73.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 918.25
ACD/KOC (pH 5.5): 4597.15
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 918.25
ACD/KOC (pH 7.4): 4597.15
Polar Surface Area: 29 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 35.8±3.0 dyne/cm
Molar Volume: 239.6±3.0 cm3

Click to predict properties on the Chemicalize site


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