ChemSpider 2D Image | 4-(Ethylsulfonyl)octahydro-2H-1,4-benzoxazine | C10H19NO3S

4-(Ethylsulfonyl)octahydro-2H-1,4-benzoxazine

  • Molecular FormulaC10H19NO3S
  • Average mass233.328 Da
  • Monoisotopic mass233.108566 Da
  • ChemSpider ID25956790

More details:






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

2H-1,4-Benzoxazine, 4-(ethylsulfonyl)octahydro- [ACD/Index Name]
4-(Ethylsulfonyl)octahydro-2H-1,4-benzoxazin [German] [ACD/IUPAC Name]
4-(Ethylsulfonyl)octahydro-2H-1,4-benzoxazine [ACD/IUPAC Name]
4-(Éthylsulfonyl)octahydro-2H-1,4-benzoxazine [French] [ACD/IUPAC Name]
1225335-72-7 [RN]
4-ethylsulfonyl-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine
MFCD16885362

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

Density: 1.2±0.1 g/cm3
Boiling Point: 359.3±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 171.1±30.7 °C
Index of Refraction: 1.528
Molar Refractivity: 58.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 5.93
ACD/KOC (pH 5.5): 124.46
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 5.93
ACD/KOC (pH 7.4): 124.46
Polar Surface Area: 55 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 45.3±5.0 dyne/cm
Molar Volume: 190.4±5.0 cm3

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