Found 1 result

Search term: 78440737 (Found by CSID)
ChemSpider 2D Image | 3-{[(2R)-2-(2-Hydroxy-2-propanyl)-6-methyl-2,3-dihydro-1-benzofuran-4-yl]oxy}-5-methylphenol | C19H22O4

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

  • Molecular FormulaC19H22O4
  • Average mass314.376 Da
  • Monoisotopic mass314.151794 Da
  • ChemSpider ID78440737

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

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

Density: 1.2±0.1 g/cm3
Boiling Point: 463.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 233.9±28.7 °C
Index of Refraction: 1.601
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 629.18
ACD/KOC (pH 5.5): 3507.12
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 623.92
ACD/KOC (pH 7.4): 3477.82
Polar Surface Area: 59 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 258.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement