ChemSpider 2D Image | 1-Heptyl-4,5,6-trimethoxy-1,2-indanediol | C19H30O5

1-Heptyl-4,5,6-trimethoxy-1,2-indanediol

  • Molecular FormulaC19H30O5
  • Average mass338.439 Da
  • Monoisotopic mass338.209320 Da
  • ChemSpider ID28290375

More details:

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

1-Heptyl-4,5,6-trimethoxy-1,2-indandiol [German] [ACD/IUPAC Name]
1-Heptyl-4,5,6-trimethoxy-1,2-indanediol [ACD/IUPAC Name]
1-Heptyl-4,5,6-triméthoxy-1,2-indanediol [French] [ACD/IUPAC Name]
1-Heptyl-4,5,6-trimethoxy-2,3-dihydro-1H-indene-1,2-diol
1H-Indene-1,2-diol, 1-heptyl-2,3-dihydro-4,5,6-trimethoxy- [ACD/Index Name]
1258275-76-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 466.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.8±3.0 kJ/mol
Flash Point: 236.1±28.7 °C
Index of Refraction: 1.533
Molar Refractivity: 94.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 340.74
ACD/KOC (pH 5.5): 2261.05
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 340.73
ACD/KOC (pH 7.4): 2261.04
Polar Surface Area: 68 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 303.0±3.0 cm3

Click to predict properties on the Chemicalize site


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