ChemSpider 2D Image | 2-Hydroxy(~2~H_4_)propane-1,2,3-tricarboxylic acid | C6H4D4O7

2-Hydroxy(2H4)propane-1,2,3-tricarboxylic acid

  • Molecular FormulaC6H4D4O7
  • Average mass196.148 Da
  • Monoisotopic mass196.052109 Da
  • ChemSpider ID17340999
  • Non-standard isotope - Non-standard isotope

More details:

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

1,2,3-Propane-1,1,3,3-d4-tricarboxylic acid, 2-hydroxy- [ACD/Index Name]
2-Hydroxy(2H4)propane-1,2,3-tricarboxylic acid
2-Hydroxy-1,2,3-(2H4)propanetricarboxylic acid [ACD/IUPAC Name]
2-Hydroxy-1,2,3-(2H4)propantricarbonsäure [German] [ACD/IUPAC Name]
Acide 2-hydroxy-1,2,3-(2H4)propanetricarboxylique [French] [ACD/IUPAC Name]
1,1,3,3-tetradeuterio-2-hydroxypropane-1,2,3-tricarboxylic acid
1,2,3-Propane-1,1,3,3-d4-tricarboxylicacid, 2-hydroxy- (9CI)
147664-83-3 [RN]
2-hydroxy((2)H4)propane-1,2,3-tricarboxylic acid
2-Hydroxy-1,2,3-propanetricarboxylic acid [ACD/IUPAC Name]

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


Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 309.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 63.8±6.0 kJ/mol
Flash Point: 155.2±24.4 °C
Index of Refraction: 1.575
Molar Refractivity: 36.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.72
ACD/LogD (pH 5.5): -6.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 104.0±3.0 dyne/cm
Molar Volume: 109.0±3.0 cm3

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