ChemSpider 2D Image | 2-Amino-3-[(~2~H_3_)methyloxy]benzoic acid | C8H6D3NO3

2-Amino-3-[(2H3)methyloxy]benzoic acid

  • Molecular FormulaC8H6D3NO3
  • Average mass170.180 Da
  • Monoisotopic mass170.077072 Da
  • ChemSpider ID107438904

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Amino-3-[(2H3)methyloxy]benzoesäure [German] [ACD/IUPAC Name]
2-Amino-3-[(2H3)methyloxy]benzoic acid [ACD/IUPAC Name]
Acide 2-amino-3-[(2H3)méthyloxy]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-amino-3-(methyl-d3-oxy)- [ACD/Index Name]
2377028-36-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 333.9±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.9±3.0 kJ/mol
Flash Point: 155.8±23.7 °C
Index of Refraction: 1.604
Molar Refractivity: 44.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 1.53
ACD/KOC (pH 5.5): 22.85
ACD/LogD (pH 7.4): -0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 128.2±3.0 cm3

Click to predict properties on the Chemicalize site


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