ChemSpider 2D Image | 2-(3,7,11,15,19,23-Hexamethyltetracosyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol | C39H72O4

2-(3,7,11,15,19,23-Hexamethyltetracosyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol

  • Molecular FormulaC39H72O4
  • Average mass604.987 Da
  • Monoisotopic mass604.543091 Da
  • ChemSpider ID13168804

More details:

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

1,4-Benzenediol, 2-(3,7,11,15,19,23-hexamethyltetracosyl)-5,6-dimethoxy-3-methyl- [ACD/Index Name]
2-(3,7,11,15,19,23-Hexamethyltetracosyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol [ACD/IUPAC Name]
2-(3,7,11,15,19,23-Hexaméthyltétracosyl)-5,6-diméthoxy-3-méthyl-1,4-benzènediol [French] [ACD/IUPAC Name]
2-(3,7,11,15,19,23-Hexamethyltetracosyl)-5,6-dimethoxy-3-methyl-1,4-benzoldiol [German] [ACD/IUPAC Name]
5-(3,7,11,15,19,23-HEXAMETHYL-TETRACOSA-2,6,10,14,18,22-HEXAENYL)-2,3-DIMETHOXY-6-METHYL-BENZENE-1,4-DIOL
UQ6

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

Density: 0.9±0.1 g/cm3
Boiling Point: 666.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 356.8±30.1 °C
Index of Refraction: 1.490
Molar Refractivity: 187.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 2
ACD/LogP: 15.42
ACD/LogD (pH 5.5): 12.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 59 Å2
Polarizability: 74.2±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 647.8±3.0 cm3

Click to predict properties on the Chemicalize site


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