ChemSpider 2D Image | 1-Methoxy-1-oxo-2-propanyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate | C18H16ClNO8

1-Methoxy-1-oxo-2-propanyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate

  • Molecular FormulaC18H16ClNO8
  • Average mass409.775 Da
  • Monoisotopic mass409.056458 Da
  • ChemSpider ID22421793

More details:

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

1-Methoxy-1-oxo-2-propanyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate [ACD/IUPAC Name]
1-Methoxy-1-oxo-2-propanyl-4-(4-chlor-2-nitrophenoxy)-3-methoxybenzoat [German] [ACD/IUPAC Name]
4-(4-Chloro-2-nitrophénoxy)-3-méthoxybenzoate de 1-méthoxy-1-oxo-2-propanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-chloro-2-nitrophenoxy)-3-methoxy-, 2-methoxy-1-methyl-2-oxoethyl ester [ACD/Index 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: 525.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.9±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 98.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 637.32
ACD/KOC (pH 5.5): 3539.67
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 637.32
ACD/KOC (pH 7.4): 3539.67
Polar Surface Area: 117 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 299.1±3.0 cm3

Click to predict properties on the Chemicalize site


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