Found 12 results

Search term: MF = 'C_{14}H_{18}N_{2}O_{9}S'
ChemSpider 2D Image | Diethyl [(4-hydroxy-3-nitrophenyl)(methylsulfonyl)amino]malonate | C14H18N2O9S

Diethyl [(4-hydroxy-3-nitrophenyl)(methylsulfonyl)amino]malonate

  • Molecular FormulaC14H18N2O9S
  • Average mass390.366 Da
  • Monoisotopic mass390.073303 Da
  • ChemSpider ID102819809

More details:

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

[(4-Hydroxy-3-nitrophényl)(méthylsulfonyl)amino]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(4-hydroxy-3-nitrophenyl)(methylsulfonyl)amino]malonate [ACD/IUPAC Name]
Diethyl-[(4-hydroxy-3-nitrophenyl)(methylsulfonyl)amino]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-[(4-hydroxy-3-nitrophenyl)(methylsulfonyl)amino]-, diethyl ester [ACD/Index 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: 535.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 277.5±32.9 °C
Index of Refraction: 1.576
Molar Refractivity: 87.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 13.59
ACD/KOC (pH 5.5): 212.51
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.79
Polar Surface Area: 164 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 265.1±3.0 cm3

Click to predict properties on the Chemicalize site


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