ChemSpider 2D Image | 2-[(8-Methyl-6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)sulfanyl]-1H-3,1-benzimidazol-3-ium | C18H14N3O3S

2-[(8-Methyl-6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)sulfanyl]-1H-3,1-benzimidazol-3-ium

  • Molecular FormulaC18H14N3O3S
  • Average mass352.387 Da
  • Monoisotopic mass352.075043 Da
  • ChemSpider ID21222938

  • Charge - Charge

More details:

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

1H-3,1-Benzimidazolium, 2-[(5,6-dihydro-8-methyl-6-oxo-1,3-dioxolo[4,5-g]quinolin-7-yl)thio]- [ACD/Index Name]
2-[(8-Methyl-6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]chinolin-7-yl)sulfanyl]-1H-3,1-benzimidazol-3-ium [German] [ACD/IUPAC Name]
2-[(8-Méthyl-6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinoléin-7-yl)sulfanyl]-1H-3,1-benzimidazol-3-ium [French] [ACD/IUPAC Name]
2-[(8-Methyl-6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)sulfanyl]-1H-3,1-benzimidazol-3-ium [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 177.69
ACD/KOC (pH 5.5): 1394.11
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 188.46
ACD/KOC (pH 7.4): 1478.63
Polar Surface Area: 103 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement