ChemSpider 2D Image | 2-Hydroxy-3-(7-hydroxy-4-oxo-4H-chromen-2-yl)-6-methoxyphenyl hydrogen sulfate | C16H12O9S

2-Hydroxy-3-(7-hydroxy-4-oxo-4H-chromen-2-yl)-6-methoxyphenyl hydrogen sulfate

  • Molecular FormulaC16H12O9S
  • Average mass380.326 Da
  • Monoisotopic mass380.020203 Da
  • ChemSpider ID74853272

More details:

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

2-Hydroxy-3-(7-hydroxy-4-oxo-4H-chromen-2-yl)-6-methoxyphenyl hydrogen sulfate [ACD/IUPAC Name]
2-Hydroxy-3-(7-hydroxy-4-oxo-4H-chromen-2-yl)-6-methoxyphenylhydrogensulfat [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 7-hydroxy-2-[2-hydroxy-4-methoxy-3-(sulfooxy)phenyl]- [ACD/Index Name]
Hydrogénosulfate de 2-hydroxy-3-(7-hydroxy-4-oxo-4H-chromén-2-yl)-6-méthoxyphényle [French] [ACD/IUPAC Name]
[2-hydroxy-3-(7-hydroxy-4-oxo-4H-chromen-2-yl)-6-methoxyphenyl]oxidanesulfonic acid
[2-hydroxy-3-(7-hydroxy-4-oxochromen-2-yl)-6-methoxyphenyl]oxidanesulfonic acid

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

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.689
Molar Refractivity: 86.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): -3.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 81.7±3.0 dyne/cm
Molar Volume: 226.2±3.0 cm3

Click to predict properties on the Chemicalize site


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