ChemSpider 2D Image | 3-Hydroxy-3-carboxymethyl-adipic acid | C8H12O7

3-Hydroxy-3-carboxymethyl-adipic acid

  • Molecular FormulaC8H12O7
  • Average mass220.177 Da
  • Monoisotopic mass220.058304 Da
  • ChemSpider ID30778478

More details:

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

3-(Carboxymethyl)-3-hydroxyhexandisäure [German] [ACD/IUPAC Name]
3-(Carboxymethyl)-3-hydroxyhexanedioic acid [ACD/IUPAC Name]
3-Hydroxy-3-carboxymethyl-adipic acid
Acide 3-(carboxyméthyl)-3-hydroxyhexanedioïque [French] [ACD/IUPAC Name]
Hexanedioic acid, 3-(carboxymethyl)-3-hydroxy- [ACD/Index Name]

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

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

Density: 1.5±0.1 g/cm3
Boiling Point: 489.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.0±6.0 kJ/mol
Flash Point: 263.8±25.2 °C
Index of Refraction: 1.551
Molar Refractivity: 45.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.16
ACD/LogD (pH 5.5): -5.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 82.2±3.0 dyne/cm
Molar Volume: 142.0±3.0 cm3

Click to predict properties on the Chemicalize site


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