Found 1 result

Search term: XSZVXQYNSLSERY (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 4-Methoxy-2-nitrophenyl 5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoate | C18H18N2O10

4-Methoxy-2-nitrophenyl 5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoate

  • Molecular FormulaC18H18N2O10
  • Average mass422.343 Da
  • Monoisotopic mass422.096130 Da
  • ChemSpider ID33054925

More details:






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

4-Methoxy-2-nitrophenyl 5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoate [ACD/IUPAC Name]
4-Methoxy-2-nitrophenyl-5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoat [German] [ACD/IUPAC Name]
5-Méthoxy-4-(2-méthoxyéthoxy)-2-nitrobenzoate de 4-méthoxy-2-nitrophényle [French] [ACD/IUPAC Name]
Benzoic acid, 5-methoxy-4-(2-methoxyethoxy)-2-nitro-, 4-methoxy-2-nitrophenyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 625.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 259.2±33.5 °C
Index of Refraction: 1.577
Molar Refractivity: 102.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 182.46
ACD/KOC (pH 5.5): 1445.92
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 182.46
ACD/KOC (pH 7.4): 1445.92
Polar Surface Area: 155 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 307.9±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement