ChemSpider 2D Image | [5-Hydroxy(2,4,6-~2~H_3_)-1H-indol-3-yl](~2~H_2_)acetic acid | C10H4D5NO3

[5-Hydroxy(2,4,6-2H3)-1H-indol-3-yl](2H2)acetic acid

  • Molecular FormulaC10H4D5NO3
  • Average mass196.214 Da
  • Monoisotopic mass196.089630 Da
  • ChemSpider ID48060207

  • Non-standard isotope - Non-standard isotope

More details:

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

[5-Hydroxy(2,4,6-2H3)-1H-indol-3-yl](2H2)acetic acid [ACD/IUPAC Name]
[5-Hydroxy(2,4,6-2H3)-1H-indol-3-yl](2H2)essigsäure [German] [ACD/IUPAC Name]
1H-Indole-2,4,6-d3-3-acetic-d2 acid, 5-hydroxy- [ACD/Index Name]
Acide [5-hydroxy(2,4,6-2H3)-1H-indol-3-yl](2H2)acétique [French] [ACD/IUPAC Name]
81587-11-3 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 497.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 254.4±24.6 °C
Index of Refraction: 1.740
Molar Refractivity: 51.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.09
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 81.7±3.0 dyne/cm
Molar Volume: 127.7±3.0 cm3

Click to predict properties on the Chemicalize site


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