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Search term: 78435094 (Found by CSID)
ChemSpider 2D Image | Ethyl [3,5-dihydroxy-2-(6-hydroxyhexanoyl)phenyl]acetate | C16H22O6

Ethyl [3,5-dihydroxy-2-(6-hydroxyhexanoyl)phenyl]acetate

  • Molecular FormulaC16H22O6
  • Average mass310.342 Da
  • Monoisotopic mass310.141632 Da
  • ChemSpider ID78435094

More details:

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

[3,5-Dihydroxy-2-(6-hydroxyhexanoyl)phényl]acétate d'éthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, 3,5-dihydroxy-2-(6-hydroxy-1-oxohexyl)-, ethyl ester [ACD/Index Name]
Ethyl [3,5-dihydroxy-2-(6-hydroxyhexanoyl)phenyl]acetate [ACD/IUPAC Name]
Ethyl-[3,5-dihydroxy-2-(6-hydroxyhexanoyl)phenyl]acetat [German] [ACD/IUPAC Name]
Dothiorelone J

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

Density: 1.2±0.1 g/cm3
Boiling Point: 511.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 185.2±23.6 °C
Index of Refraction: 1.557
Molar Refractivity: 80.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.56
ACD/KOC (pH 5.5): 516.51
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 19.89
ACD/KOC (pH 7.4): 235.76
Polar Surface Area: 104 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 250.7±3.0 cm3

Click to predict properties on the Chemicalize site


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