ChemSpider 2D Image | 3-{[(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acetyl](3-ethoxypropyl)amino}-2-methylpropanoic acid | C19H26ClNO6

3-{[(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acetyl](3-ethoxypropyl)amino}-2-methylpropanoic acid

  • Molecular FormulaC19H26ClNO6
  • Average mass399.866 Da
  • Monoisotopic mass399.144867 Da
  • ChemSpider ID53678863

More details:

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

3-{[(8-Chlor-2,3-dihydro-1,4-benzodioxin-6-yl)acetyl](3-ethoxypropyl)amino}-2-methylpropansäure [German] [ACD/IUPAC Name]
3-{[(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acetyl](3-ethoxypropyl)amino}-2-methylpropanoic acid [ACD/IUPAC Name]
Acide 3-{[2-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acétyl](3-éthoxypropyl)amino}-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[[2-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acetyl](3-ethoxypropyl)amino]-2-methyl- [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: 577.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 302.8±30.1 °C
Index of Refraction: 1.544
Molar Refractivity: 100.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 4.46
ACD/KOC (pH 5.5): 42.93
ACD/LogD (pH 7.4): -0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 317.4±3.0 cm3

Click to predict properties on the Chemicalize site


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