ChemSpider 2D Image | 2-Imino-7,7-dimethyl-4-phenyl-2,6,7,8-tetrahydro-5H-1,3-benzothiazin-5-one | C16H16N2OS

2-Imino-7,7-dimethyl-4-phenyl-2,6,7,8-tetrahydro-5H-1,3-benzothiazin-5-one

  • Molecular FormulaC16H16N2OS
  • Average mass284.376 Da
  • Monoisotopic mass284.098328 Da
  • ChemSpider ID28611842

More details:

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

1374509-65-5 [RN]
2-Imino-7,7-dimethyl-4-phenyl-2,6,7,8-tetrahydro-5H-1,3-benzothiazin-5-on [German] [ACD/IUPAC Name]
2-Imino-7,7-dimethyl-4-phenyl-2,6,7,8-tetrahydro-5H-1,3-benzothiazin-5-one [ACD/IUPAC Name]
2-Imino-7,7-diméthyl-4-phényl-2,6,7,8-tétrahydro-5H-1,3-benzothiazin-5-one [French] [ACD/IUPAC Name]
2-imino-7,7-dimethyl-4-phenyl-5,6,7,8-tetrahydro-2H-1,3-benzothiazin-5-one
5H-1,3-Benzothiazin-5-one, 2,6,7,8-tetrahydro-2-imino-7,7-dimethyl-4-phenyl- [ACD/Index Name]
2-Imino-7,7-dimethyl-4-phenyl-2,6,7,8-tetrahydro-benzo[e][1,3]thiazin-5-one
2-imino-7,7-dimethyl-4-phenyl-6,8-dihydro-1,3-benzothiazin-5-one
2-Imino-7,7-dimethyl-4-phenyl-7,8-dihydro-2H-benzo[e][1,3]thiazin-5(6H)-one
MFCD22374926 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 423.6±48.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.8±3.0 kJ/mol
    Flash Point: 210.0±29.6 °C
    Index of Refraction: 1.667
    Molar Refractivity: 82.4±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.38
    ACD/LogD (pH 5.5): 3.03
    ACD/BCF (pH 5.5): 114.60
    ACD/KOC (pH 5.5): 1007.57
    ACD/LogD (pH 7.4): 3.07
    ACD/BCF (pH 7.4): 126.44
    ACD/KOC (pH 7.4): 1111.68
    Polar Surface Area: 79 Å2
    Polarizability: 32.7±0.5 10-24cm3
    Surface Tension: 50.2±7.0 dyne/cm
    Molar Volume: 221.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement