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Search term: 30824691 (Found by CSID)
ChemSpider 2D Image | 3-Hydroxy-1-(4-hydroxyphenyl)-5-methyl-2-hexanone | C13H18O3

3-Hydroxy-1-(4-hydroxyphenyl)-5-methyl-2-hexanone

  • Molecular FormulaC13H18O3
  • Average mass222.280 Da
  • Monoisotopic mass222.125595 Da
  • ChemSpider ID30824691

More details:

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

2-Hexanone, 3-hydroxy-1-(4-hydroxyphenyl)-5-methyl- [ACD/Index Name]
3-Hydroxy-1-(4-hydroxyphenyl)-5-methyl-2-hexanon [German] [ACD/IUPAC Name]
3-Hydroxy-1-(4-hydroxyphenyl)-5-methyl-2-hexanone [ACD/IUPAC Name]
3-Hydroxy-1-(4-hydroxyphényl)-5-méthyl-2-hexanone [French] [ACD/IUPAC Name]
Soraphinol C

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

Density: 1.1±0.1 g/cm3
Boiling Point: 370.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.2±3.0 kJ/mol
Flash Point: 192.3±18.8 °C
Index of Refraction: 1.540
Molar Refractivity: 62.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 19.71
ACD/KOC (pH 5.5): 294.00
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.63
ACD/KOC (pH 7.4): 292.86
Polar Surface Area: 58 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 198.6±3.0 cm3

Click to predict properties on the Chemicalize site


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