ChemSpider 2D Image | 4-[(3-Acetoxy-2-hydroxypropoxy)methyl]-3-hydroxy-5-(hydroxymethyl)-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate | C26H32O10

4-[(3-Acetoxy-2-hydroxypropoxy)methyl]-3-hydroxy-5-(hydroxymethyl)-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate

  • Molecular FormulaC26H32O10
  • Average mass504.526 Da
  • Monoisotopic mass504.199554 Da
  • ChemSpider ID78435366

More details:

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

2,4-Dihydroxy-6-méthylbenzoate de 4-[(3-acétoxy-2-hydroxypropoxy)méthyl]-3-hydroxy-5-(hydroxyméthyl)-2-(3-méthyl-2-butén-1-yl)phényle [French] [ACD/IUPAC Name]
4-[(3-Acetoxy-2-hydroxypropoxy)methyl]-3-hydroxy-5-(hydroxymethyl)-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate [ACD/IUPAC Name]
4-[(3-Acetoxy-2-hydroxypropoxy)methyl]-3-hydroxy-5-(hydroxymethyl)-2-(3-methyl-2-buten-1-yl)phenyl-2,4-dihydroxy-6-methylbenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2,4-dihydroxy-6-methyl-, 4-[[3-(acetyloxy)-2-hydroxypropoxy]methyl]-3-hydroxy-5-(hydroxymethyl)-2-(3-methyl-2-buten-1-yl)phenyl ester [ACD/Index Name]
Sterenin I

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

Density: 1.3±0.1 g/cm3
Boiling Point: 740.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.4±3.0 kJ/mol
Flash Point: 245.7±26.4 °C
Index of Refraction: 1.606
Molar Refractivity: 131.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 255.80
ACD/KOC (pH 5.5): 1834.12
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 117.70
ACD/KOC (pH 7.4): 843.95
Polar Surface Area: 163 Å2
Polarizability: 52.0±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 380.6±3.0 cm3

Click to predict properties on the Chemicalize site


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