ChemSpider 2D Image | 2-[(~2~H_3_)Methyloxy]nicotinic acid | C7H4D3NO3

2-[(2H3)Methyloxy]nicotinic acid

  • Molecular FormulaC7H4D3NO3
  • Average mass156.154 Da
  • Monoisotopic mass156.061417 Da
  • ChemSpider ID113567681

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[(2H3)Methyloxy]nicotinic acid [ACD/IUPAC Name]
2-[(2H3)Methyloxy]nicotinsäure [German] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 2-(methyl-d3-oxy)- [ACD/Index Name]
Acide 2-[(2H3)méthyloxy]nicotinique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 285.5±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 126.5±21.8 °C
Index of Refraction: 1.550
Molar Refractivity: 38.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 119.2±3.0 cm3

Click to predict properties on the Chemicalize site


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