ChemSpider 2D Image | 2,5-Bis(2,6-dimethyl-2-heptanyl)-1,4-benzenediol | C24H42O2

2,5-Bis(2,6-dimethyl-2-heptanyl)-1,4-benzenediol

  • Molecular FormulaC24H42O2
  • Average mass362.589 Da
  • Monoisotopic mass362.318481 Da
  • ChemSpider ID28677705

More details:






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

1,4-Benzenediol, 2,5-bis(1,1,5-trimethylhexyl)- [ACD/Index Name]
2,5-Bis(2,6-dimethyl-2-heptanyl)-1,4-benzenediol [ACD/IUPAC Name]
2,5-Bis(2,6-diméthyl-2-heptanyl)-1,4-benzènediol [French] [ACD/IUPAC Name]
2,5-Bis(2,6-dimethyl-2-heptanyl)-1,4-benzoldiol [German] [ACD/IUPAC Name]
117380-83-3 [RN]
2,5-Bis(2,6-dimethylheptan-2-yl)benzene-1,4-diol

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 466.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.7±3.0 kJ/mol
Flash Point: 193.2±21.9 °C
Index of Refraction: 1.498
Molar Refractivity: 113.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 8.97
ACD/LogD (pH 5.5): 8.23
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 716799.50
ACD/LogD (pH 7.4): 8.23
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 716521.75
Polar Surface Area: 40 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 33.3±3.0 dyne/cm
Molar Volume: 385.5±3.0 cm3

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