ChemSpider 2D Image | 1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-1-oxo-2-propanyl 8-chloro-2,3-dihydro-1,4-benzodioxine-6-carboxylate | C20H18ClNO7

1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-1-oxo-2-propanyl 8-chloro-2,3-dihydro-1,4-benzodioxine-6-carboxylate

  • Molecular FormulaC20H18ClNO7
  • Average mass419.812 Da
  • Monoisotopic mass419.077179 Da
  • ChemSpider ID30581534

More details:

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

1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-1-oxo-2-propanyl 8-chloro-2,3-dihydro-1,4-benzodioxine-6-carboxylate [ACD/IUPAC Name]
1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-1-oxo-2-propanyl-8-chlor-2,3-dihydro-1,4-benzodioxin-6-carboxylat [German] [ACD/IUPAC Name]
1,4-Benzodioxin-6-carboxylic acid, 8-chloro-2,3-dihydro-, 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-methyl-2-oxoethyl ester [ACD/Index Name]
8-Chloro-2,3-dihydro-1,4-benzodioxine-6-carboxylate de 1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxo-2-propanyle [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: 648.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 345.7±31.5 °C
Index of Refraction: 1.624
Molar Refractivity: 102.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 235.20
ACD/KOC (pH 5.5): 1734.13
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 235.20
ACD/KOC (pH 7.4): 1734.12
Polar Surface Area: 92 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 291.5±3.0 cm3

Click to predict properties on the Chemicalize site


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