ChemSpider 2D Image | 4-[3-Amino-6-(3,4,5-trimethoxyphenyl)-2-pyrazinyl]-2-ethoxybenzoic acid | C22H23N3O6

4-[3-Amino-6-(3,4,5-trimethoxyphenyl)-2-pyrazinyl]-2-ethoxybenzoic acid

  • Molecular FormulaC22H23N3O6
  • Average mass425.435 Da
  • Monoisotopic mass425.158691 Da
  • ChemSpider ID25060028

More details:






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

4-[3-Amino-6-(3,4,5-trimethoxyphenyl)-2-pyrazinyl]-2-ethoxybenzoesäure [German] [ACD/IUPAC Name]
4-[3-Amino-6-(3,4,5-trimethoxyphenyl)-2-pyrazinyl]-2-ethoxybenzoic acid [ACD/IUPAC Name]
4-[3-Amino-6-(3,4,5-Trimethoxyphenyl)pyrazin-2-Yl]-2-Ethoxybenzoic Acid
Acide 4-[3-amino-6-(3,4,5-triméthoxyphényl)-2-pyrazinyl]-2-éthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-amino-6-(3,4,5-trimethoxyphenyl)-2-pyrazinyl]-2-ethoxy- [ACD/Index Name]
OL2

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

Density: 1.3±0.1 g/cm3
Boiling Point: 574.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 301.0±30.1 °C
Index of Refraction: 1.600
Molar Refractivity: 114.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 2.54
ACD/KOC (pH 5.5): 19.68
ACD/LogD (pH 7.4): 0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.32
Polar Surface Area: 126 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 333.8±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement