ChemSpider 2D Image | 2-{[(2-Ethylhexyl)oxy](oxo)(~13~C)methyl}(carboxy,1,2-~13~C_3_)benzoic acid | C1213C4H22O4

2-{[(2-Ethylhexyl)oxy](oxo)(13C)methyl}(carboxy,1,2-13C3)benzoic acid

  • Molecular FormulaC1213C4H22O4
  • Average mass282.314 Da
  • Monoisotopic mass282.165222 Da
  • ChemSpider ID4932103

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2-Benzene-1,2-13C2-dicarboxylic-13C2 acid, mono(2-ethylhexyl) ester [ACD/Index Name]
2-{[(2-Ethylhexyl)oxy](oxo)(13C)methyl}(carboxy,1,2-13C3)benzoesäure [German] [ACD/IUPAC Name]
2-{[(2-Ethylhexyl)oxy](oxo)(13C)methyl}(carboxy,1,2-13C3)benzoic acid [ACD/IUPAC Name]
Acide 2-{[(2-éthylhexyl)oxy](oxo)(13C)méthyl}(carboxy,1,2-13C3)benzoïque [French] [ACD/IUPAC Name]
mono-2-ethylhexyl phthalate
Mono-2-ethylhexyl phthalate-13C4

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.517
Molar Refractivity: 77.3±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 255.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement