ChemSpider 2D Image | Ethyl ({2-[(2-methoxy-4-nitrophenyl)amino]-2-oxoethyl}sulfinyl)acetate | C13H16N2O7S

Ethyl ({2-[(2-methoxy-4-nitrophenyl)amino]-2-oxoethyl}sulfinyl)acetate

  • Molecular FormulaC13H16N2O7S
  • Average mass344.340 Da
  • Monoisotopic mass344.067810 Da
  • ChemSpider ID22474882

More details:

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

({2-[(2-Méthoxy-4-nitrophényl)amino]-2-oxoéthyl}sulfinyl)acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[2-[(2-methoxy-4-nitrophenyl)amino]-2-oxoethyl]sulfinyl]-, ethyl ester [ACD/Index Name]
Ethyl ({2-[(2-methoxy-4-nitrophenyl)amino]-2-oxoethyl}sulfinyl)acetate [ACD/IUPAC Name]
Ethyl-({2-[(2-methoxy-4-nitrophenyl)amino]-2-oxoethyl}sulfinyl)acetat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 618.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 328.1±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 82.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.68
ACD/KOC (pH 5.5): 88.53
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.68
ACD/KOC (pH 7.4): 88.49
Polar Surface Area: 147 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 66.5±3.0 dyne/cm
Molar Volume: 237.4±3.0 cm3

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