ChemSpider 2D Image | Bis(5-methylhexyl) 1,2-(~2~H_4_)benzenedicarboxylate | C22H30D4O4

Bis(5-methylhexyl) 1,2-(2H4)benzenedicarboxylate

  • Molecular FormulaC22H30D4O4
  • Average mass366.528 Da
  • Monoisotopic mass366.270813 Da
  • ChemSpider ID30773503

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2-(2H4)Benzènedicarboxylate de bis(5-méthylhexyle) [French] [ACD/IUPAC Name]
1,2-Benzene-d4-dicarboxylic acid, bis(5-methylhexyl) ester [ACD/Index Name]
Bis(5-methylhexyl) 1,2-(2H4)benzenedicarboxylate [ACD/IUPAC Name]
Bis(5-methylhexyl)-1,2-(2H4)benzoldicarboxylat [German] [ACD/IUPAC Name]
Bis(5-methylhexyl) Phthalate-3,4,5,6-d4
Diisoheptyl phthalate
Di-iso-heptyl phthalate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 363.6±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.0±3.0 kJ/mol
Flash Point: 192.4±8.5 °C
Index of Refraction: 1.490
Molar Refractivity: 105.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 6.42
ACD/BCF (pH 5.5): 44467.06
ACD/KOC (pH 5.5): 73900.70
ACD/LogD (pH 7.4): 6.42
ACD/BCF (pH 7.4): 44467.06
ACD/KOC (pH 7.4): 73900.70
Polar Surface Area: 53 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 364.1±3.0 cm3

Click to predict properties on the Chemicalize site


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