ChemSpider 2D Image | 4-Formyl-3-hydroxy-5-methyl-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate | C21H22O6

4-Formyl-3-hydroxy-5-methyl-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate

  • Molecular FormulaC21H22O6
  • Average mass370.396 Da
  • Monoisotopic mass370.141632 Da
  • ChemSpider ID78435325

More details:

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

2,4-Dihydroxy-6-méthylbenzoate de 4-formyl-3-hydroxy-5-méthyl-2-(3-méthyl-2-butén-1-yl)phényle [French] [ACD/IUPAC Name]
4-Formyl-3-hydroxy-5-methyl-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate [ACD/IUPAC Name]
4-Formyl-3-hydroxy-5-methyl-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-formyl-3-hydroxy-5-methyl-2-(3-methyl-2-buten-1-yl)phenyl ester [ACD/Index Name]
Sterenin G

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

Density: 1.3±0.1 g/cm3
Boiling Point: 576.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.6±3.0 kJ/mol
Flash Point: 202.2±23.6 °C
Index of Refraction: 1.636
Molar Refractivity: 103.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 5.43
ACD/BCF (pH 5.5): 7783.39
ACD/KOC (pH 5.5): 21100.71
ACD/LogD (pH 7.4): 4.93
ACD/BCF (pH 7.4): 2480.28
ACD/KOC (pH 7.4): 6724.01
Polar Surface Area: 104 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 288.1±3.0 cm3

Click to predict properties on the Chemicalize site


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