ChemSpider 2D Image | 2-[2-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazino]-2-oxoethyl 3-chloro-4-ethoxy-5-methoxybenzoate | C21H21ClN2O8

2-[2-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazino]-2-oxoethyl 3-chloro-4-ethoxy-5-methoxybenzoate

  • Molecular FormulaC21H21ClN2O8
  • Average mass464.853 Da
  • Monoisotopic mass464.098633 Da
  • ChemSpider ID33003341

More details:

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

1,4-Benzodioxin-2-carboxylic acid, 2,3-dihydro-, 2-[2-[(3-chloro-4-ethoxy-5-methoxybenzoyl)oxy]acetyl]hydrazide [ACD/Index Name]
2-[2-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazino]-2-oxoethyl 3-chloro-4-ethoxy-5-methoxybenzoate [ACD/IUPAC Name]
2-[2-(2,3-Dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazino]-2-oxoethyl-3-chlor-4-ethoxy-5-methoxybenzoat [German] [ACD/IUPAC Name]
3-Chloro-4-éthoxy-5-méthoxybenzoate de 2-[2-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)hydrazino]-2-oxoéthyle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 725.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.3±32.9 °C
Index of Refraction: 1.576
Molar Refractivity: 112.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.01
ACD/KOC (pH 5.5): 387.66
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.56
ACD/KOC (pH 7.4): 381.68
Polar Surface Area: 121 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 339.6±3.0 cm3

Click to predict properties on the Chemicalize site


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