ChemSpider 2D Image | 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol | C13H22O

4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol

  • Molecular FormulaC13H22O
  • Average mass194.313 Da
  • Monoisotopic mass194.167068 Da
  • ChemSpider ID21105921

More details:

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

246-815-7 [EINECS]
3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- [ACD/Index Name]
4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol [ACD/IUPAC Name]
4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol [German] [ACD/IUPAC Name]
4-(2,6,6-Triméthyl-2-cyclohexén-1-yl)-3-butén-2-ol [French] [ACD/IUPAC Name]
4-(2,6,6-Trimethylcyclohex-2-en-1-yl)but-3-en-2-ol
472-78-6 [RN]
25312-34-9 [RN]
4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-buten-2-ol
α-Ionol

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

Density: 0.9±0.1 g/cm3
Boiling Point: 265.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.4±6.0 kJ/mol
Flash Point: 96.2±20.6 °C
Index of Refraction: 1.524
Molar Refractivity: 63.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 475.80
ACD/KOC (pH 5.5): 2871.47
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 475.80
ACD/KOC (pH 7.4): 2871.47
Polar Surface Area: 20 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 206.4±3.0 cm3

Click to predict properties on the Chemicalize site


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