ChemSpider 2D Image | 5-[(8E,11Z)-8,11-Pentadecadien-1-yl]-1,3-benzenediol | C21H32O2

5-[(8E,11Z)-8,11-Pentadecadien-1-yl]-1,3-benzenediol

  • Molecular FormulaC21H32O2
  • Average mass316.478 Da
  • Monoisotopic mass316.240234 Da
  • ChemSpider ID95674284

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3-Benzenediol, 5-[(8E,11Z)-8,11-pentadecadien-1-yl]- [ACD/Index Name]
5-[(8E,11Z)-8,11-Pentadecadien-1-yl]-1,3-benzenediol [ACD/IUPAC Name]
5-[(8E,11Z)-8,11-Pentadécadién-1-yl]-1,3-benzènediol [French] [ACD/IUPAC Name]
5-[(8E,11Z)-8,11-Pentadecadien-1-yl]-1,3-benzoldiol [German] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 472.4±30.0 °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: 208.3±19.2 °C
Index of Refraction: 1.535
Molar Refractivity: 99.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.62
ACD/LogD (pH 5.5): 6.49
ACD/BCF (pH 5.5): 50761.34
ACD/KOC (pH 5.5): 81244.03
ACD/LogD (pH 7.4): 6.49
ACD/BCF (pH 7.4): 50406.00
ACD/KOC (pH 7.4): 80675.31
Polar Surface Area: 40 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 320.9±3.0 cm3

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