ChemSpider 2D Image | 8-[(E)-Hydrazonomethyl]-4-methyl-2-oxo-2H-chromen-7-yl 4-methylbenzenesulfonate | C18H16N2O5S

8-[(E)-Hydrazonomethyl]-4-methyl-2-oxo-2H-chromen-7-yl 4-methylbenzenesulfonate

  • Molecular FormulaC18H16N2O5S
  • Average mass372.395 Da
  • Monoisotopic mass372.078003 Da
  • ChemSpider ID30656489
  • Double-bond stereo - Double-bond stereo


More details:






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

2H-1-Benzopyran-8-carboxaldehyde, 4-methyl-7-[[(4-methylphenyl)sulfonyl]oxy]-2-oxo-, 8-hydrazone [ACD/Index Name]
4-Méthylbenzènesulfonate de 8-[(E)-hydrazonométhyl]-4-méthyl-2-oxo-2H-chromén-7-yle [French] [ACD/IUPAC Name]
8-[(E)-Hydrazonomethyl]-4-methyl-2-oxo-2H-chromen-7-yl 4-methylbenzenesulfonate [ACD/IUPAC Name]
8-[(E)-Hydrazonomethyl]-4-methyl-2-oxo-2H-chromen-7-yl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 625.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.0±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 95.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 66.82
ACD/KOC (pH 5.5): 704.48
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.82
ACD/KOC (pH 7.4): 704.48
Polar Surface Area: 116 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 267.1±7.0 cm3

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