ChemSpider 2D Image | 3-(2-Carboxyethyl)phthalic acid | C11H10O6

3-(2-Carboxyethyl)phthalic acid

  • Molecular FormulaC11H10O6
  • Average mass238.193 Da
  • Monoisotopic mass238.047745 Da
  • ChemSpider ID35035182

More details:

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

1,2-Benzenedicarboxylic acid, 3-(2-carboxyethyl)- [ACD/Index Name]
3-(2-Carboxyethyl)benzene-1,2-Dicarboxylic Acid
3-(2-Carboxyethyl)phthalic acid [ACD/IUPAC Name]
3-(2-Carboxyethyl)phthalsäure [German] [ACD/IUPAC Name]
Acide 3-(2-carboxyéthyl)phtalique [French] [ACD/IUPAC Name]
1803746-76-0 [RN]
2,3-Dicarboxyphenylpropanoic acid
3JM

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

Density: 1.5±0.1 g/cm3
Boiling Point: 499.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 270.0±23.8 °C
Index of Refraction: 1.623
Molar Refractivity: 55.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -2.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 77.2±3.0 dyne/cm
Molar Volume: 158.4±3.0 cm3

Click to predict properties on the Chemicalize site


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