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Search term: 78440841 (Found by CSID)
ChemSpider 2D Image | 3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-methyl-5-(3-methyl-2-buten-1-yl)-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-methylphenol | C24H30O4

3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-methyl-5-(3-methyl-2-buten-1-yl)-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-methylphenol

  • Molecular FormulaC24H30O4
  • Average mass382.493 Da
  • Monoisotopic mass382.214417 Da
  • ChemSpider ID78440841

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Benzofuranmethanol, 2,3-dihydro-4-(3-hydroxy-5-methylphenoxy)-α,α,6-trimethyl-5-(3-methyl-2-buten-1-yl)-, (2R)- [ACD/Index Name]
3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-methyl-5-(3-methyl-2-buten-1-yl)-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-methylphenol [German] [ACD/IUPAC Name]
3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-methyl-5-(3-methyl-2-buten-1-yl)-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-methylphenol [ACD/IUPAC Name]
3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-méthyl-5-(3-méthyl-2-butén-1-yl)-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-méthylphénol [French] [ACD/IUPAC Name]
α,α,6-Trimethyl-4-(3-hydroxy-5-methylphenoxy)-5-prenyl-2,3-dihydrobenzofuran-2β-methanol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 510.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 262.5±30.1 °C
Index of Refraction: 1.584
Molar Refractivity: 111.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.79
ACD/LogD (pH 5.5): 5.50
ACD/BCF (pH 5.5): 8910.92
ACD/KOC (pH 5.5): 23384.67
ACD/LogD (pH 7.4): 5.50
ACD/BCF (pH 7.4): 8836.47
ACD/KOC (pH 7.4): 23189.31
Polar Surface Area: 59 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 334.1±3.0 cm3

Click to predict properties on the Chemicalize site


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