ChemSpider 2D Image | MFCD07799869 | C13H12N2O6S

MFCD07799869

  • Molecular FormulaC13H12N2O6S
  • Average mass324.309 Da
  • Monoisotopic mass324.041595 Da
  • ChemSpider ID21491557

More details:

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

39272-74-7 [RN]
Acetamide, N-[4-[[(5-nitro-2-furanyl)methyl]sulfonyl]phenyl]- [ACD/Index Name]
MFCD07799869
N-(4-(((5-NITRO-2-FURYL)METHYL)SULFONYL)PHENYL)ACETAMIDE
N-(4-{[(5-Nitro-2-furyl)methyl]sulfonyl}phenyl)acetamid [German] [ACD/IUPAC Name]
N-(4-{[(5-Nitro-2-furyl)methyl]sulfonyl}phenyl)acetamide [ACD/IUPAC Name]
N-(4-{[(5-Nitro-2-furyl)méthyl]sulfonyl}phényl)acétamide [French] [ACD/IUPAC Name]
N-(4-(((5-Nitrofuran-2-yl)methyl)sulfonyl)phenyl)acetamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 642.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.2±31.5 °C
Index of Refraction: 1.613
Molar Refractivity: 76.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.00
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 3.26
ACD/KOC (pH 5.5): 81.01
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.26
ACD/KOC (pH 7.4): 81.01
Polar Surface Area: 131 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 64.0±3.0 dyne/cm
Molar Volume: 219.6±3.0 cm3

Click to predict properties on the Chemicalize site


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