ChemSpider 2D Image | 6-Hydroxy-7-methoxy-3-methyl-2-thioxo-2,3-dihydro-4H-1,3-benzothiazin-4-one | C10H9NO3S2

6-Hydroxy-7-methoxy-3-methyl-2-thioxo-2,3-dihydro-4H-1,3-benzothiazin-4-one

  • Molecular FormulaC10H9NO3S2
  • Average mass255.313 Da
  • Monoisotopic mass255.002380 Da
  • ChemSpider ID25054041

More details:

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

4H-1,3-Benzothiazin-4-one, 2,3-dihydro-6-hydroxy-7-methoxy-3-methyl-2-thioxo- [ACD/Index Name]
6-Hydroxy-7-methoxy-3-methyl-2-thioxo-2,3-dihydro-4H-1,3-benzothiazin-4-on [German] [ACD/IUPAC Name]
6-Hydroxy-7-methoxy-3-methyl-2-thioxo-2,3-dihydro-4H-1,3-benzothiazin-4-one [ACD/IUPAC Name]
6-Hydroxy-7-méthoxy-3-méthyl-2-thioxo-2,3-dihydro-4H-1,3-benzothiazin-4-one [French] [ACD/IUPAC Name]
BRETSCHNEIDERAZINE A

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

Density: 1.6±0.1 g/cm3
Boiling Point: 463.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 234.4±31.5 °C
Index of Refraction: 1.741
Molar Refractivity: 65.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.70
ACD/KOC (pH 5.5): 105.14
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 3.30
ACD/KOC (pH 7.4): 73.86
Polar Surface Area: 107 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 87.5±5.0 dyne/cm
Molar Volume: 162.5±5.0 cm3

Click to predict properties on the Chemicalize site


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