ChemSpider 2D Image | 1,2-Bis(6-methylheptyl) 4-(8-methylnonyl) 1,2,4-benzenetricarboxylate | C35H58O6

1,2-Bis(6-methylheptyl) 4-(8-methylnonyl) 1,2,4-benzenetricarboxylate

  • Molecular FormulaC35H58O6
  • Average mass574.831 Da
  • Monoisotopic mass574.423340 Da
  • ChemSpider ID34997129

More details:

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

1,2,4-Benzènetricarboxylate de 1,2-bis(6-méthylheptyle) et de 4-(8-méthylnonyle) [French] [ACD/IUPAC Name]
1,2,4-Benzenetricarboxylic acid, 1,2-bis(6-methylheptyl) 4-(8-methylnonyl) ester [ACD/Index Name]
1,2-Bis(6-methylheptyl) 4-(8-methylnonyl) 1,2,4-benzenetricarboxylate [ACD/IUPAC Name]
1,2-Bis(6-methylheptyl)-4-(8-methylnonyl)-1,2,4-benzoltricarboxylat [German] [ACD/IUPAC Name]
12694-45-0 [RN]
Isodecyl diisooctyl benzene-1,2,4-tricarboxylate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 606.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 245.2±26.0 °C
Index of Refraction: 1.487
Molar Refractivity: 168.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 13.86
ACD/LogD (pH 5.5): 11.67
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.67
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 79 Å2
Polarizability: 66.6±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 583.9±3.0 cm3

Click to predict properties on the Chemicalize site


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