ChemSpider 2D Image | 2-Methoxybenzyl 3,4,5-trimethoxy-2-nitrobenzoate | C18H19NO8

2-Methoxybenzyl 3,4,5-trimethoxy-2-nitrobenzoate

  • Molecular FormulaC18H19NO8
  • Average mass377.345 Da
  • Monoisotopic mass377.111053 Da
  • ChemSpider ID30576110

More details:

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

2-Methoxybenzyl 3,4,5-trimethoxy-2-nitrobenzoate [ACD/IUPAC Name]
2-Methoxybenzyl-3,4,5-trimethoxy-2-nitrobenzoat [German] [ACD/IUPAC Name]
3,4,5-Triméthoxy-2-nitrobenzoate de 2-méthoxybenzyle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trimethoxy-2-nitro-, (2-methoxyphenyl)methyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 539.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.7±3.0 kJ/mol
Flash Point: 219.1±30.7 °C
Index of Refraction: 1.561
Molar Refractivity: 95.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.30
ACD/KOC (pH 5.5): 774.69
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.30
ACD/KOC (pH 7.4): 774.69
Polar Surface Area: 109 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 295.9±3.0 cm3

Click to predict properties on the Chemicalize site


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