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Search term: YOBSLJXUEIUCHT-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-(1,1-Dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)-4H-chromen-4-one | C16H12N2O4S

3-(1,1-Dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)-4H-chromen-4-one

  • Molecular FormulaC16H12N2O4S
  • Average mass328.342 Da
  • Monoisotopic mass328.051788 Da
  • ChemSpider ID30822912

More details:

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

3-(1,1-Dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
3-(1,1-Dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)-4H-chromen-4-one [ACD/IUPAC Name]
3-(1,1-Dioxydo-3,4-dihydro-2H-1,2,4-benzothiadiazin-3-yl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-(3,4-dihydro-1,1-dioxido-2H-1,2,4-benzothiadiazin-3-yl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 558.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.1±3.0 kJ/mol
Flash Point: 291.8±32.9 °C
Index of Refraction: 1.670
Molar Refractivity: 83.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.87
ACD/KOC (pH 5.5): 191.96
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 9.82
ACD/KOC (pH 7.4): 173.38
Polar Surface Area: 93 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 223.6±3.0 cm3

Click to predict properties on the Chemicalize site


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