ChemSpider 2D Image | 1-(4-Hydroxy-3-methoxyphenyl)-3-undecanone | C18H28O3

1-(4-Hydroxy-3-methoxyphenyl)-3-undecanone

  • Molecular FormulaC18H28O3
  • Average mass292.413 Da
  • Monoisotopic mass292.203857 Da
  • ChemSpider ID14877720

More details:

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

1-(4-Hydroxy-3-methoxyphenyl)-3-undecanon [German] [ACD/IUPAC Name]
1-(4-Hydroxy-3-methoxyphenyl)-3-undecanone [ACD/IUPAC Name]
1-(4-Hydroxy-3-méthoxyphényl)-3-undécanone [French] [ACD/IUPAC Name]
1-(4-hydroxy-3-methoxyphenyl)undecan-3-one
3-Undecanone, 1-(4-hydroxy-3-methoxyphenyl)- [ACD/Index Name]
53172-04-6 [RN]
[7]-Paradol
1-(4-Hydroxy-3-methoxy-phenyl)-undecan-3-one
4-Hydroxy-3-methoxyphenethyl octyl ketone
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL431200/

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 419.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.0±3.0 kJ/mol
Flash Point: 142.7±18.1 °C
Index of Refraction: 1.505
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1587.49
ACD/KOC (pH 5.5): 6802.43
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1583.77
ACD/KOC (pH 7.4): 6786.47
Polar Surface Area: 47 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 290.4±3.0 cm3

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