ChemSpider 2D Image | N-[4-(Methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-7-yl]-2-thiophenesulfonamide | C13H14N2O5S3

N-[4-(Methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-7-yl]-2-thiophenesulfonamide

  • Molecular FormulaC13H14N2O5S3
  • Average mass374.456 Da
  • Monoisotopic mass374.006000 Da
  • ChemSpider ID25341965

More details:

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

2-Thiophenesulfonamide, N-[3,4-dihydro-4-(methylsulfonyl)-2H-1,4-benzoxazin-7-yl]- [ACD/Index Name]
N-[4-(Methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-7-yl]-2-thiophenesulfonamide [ACD/IUPAC Name]
N-[4-(Méthylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-7-yl]-2-thiophènesulfonamide [French] [ACD/IUPAC Name]
N-[4-(Methylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-7-yl]-2-thiophensulfonamid [German] [ACD/IUPAC Name]

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

Density: 1.6±0.0 g/cm3
Boiling Point: 578.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 86.6±0.0 kJ/mol
Flash Point: 303.7±0.0 °C
Index of Refraction: 1.697
Molar Refractivity: 88.4±0.0 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 108.49
ACD/KOC (pH 5.5): 980.85
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 21.28
ACD/KOC (pH 7.4): 192.41
Polar Surface Area: 138 Å2
Polarizability: 35.0±0.0 10-24cm3
Surface Tension: 79.1±0.0 dyne/cm
Molar Volume: 229.2±0.0 cm3

Click to predict properties on the Chemicalize site


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