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Search term: VFGZUPCXJDHWOL-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 7-(Benzyloxy)-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one | C16H13N3O2S

7-(Benzyloxy)-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one

  • Molecular FormulaC16H13N3O2S
  • Average mass311.358 Da
  • Monoisotopic mass311.072845 Da
  • ChemSpider ID30832114

More details:

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

1H-[1,2,4]Triazolo[3,4-c][1,4]benzothiazin-1-one, 2,4-dihydro-7-(phenylmethoxy)- [ACD/Index Name]
7-(Benzyloxy)-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-on [German] [ACD/IUPAC Name]
7-(Benzyloxy)-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one [ACD/IUPAC Name]
7-(Benzyloxy)-2,4-dihydro-1H-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.736
Molar Refractivity: 86.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.79
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 9.40
ACD/KOC (pH 5.5): 147.77
ACD/LogD (pH 7.4): 0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.75
Polar Surface Area: 79 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 61.4±7.0 dyne/cm
Molar Volume: 214.6±7.0 cm3

Click to predict properties on the Chemicalize site


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