ChemSpider 2D Image | 2-Hydroxy-5-[(1E)-3-oxo-1-buten-1-yl]phenyl hydrogen sulfate | C10H10O6S

2-Hydroxy-5-[(1E)-3-oxo-1-buten-1-yl]phenyl hydrogen sulfate

  • Molecular FormulaC10H10O6S
  • Average mass258.248 Da
  • Monoisotopic mass258.019806 Da
  • ChemSpider ID74853914

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Hydroxy-5-[(1E)-3-oxo-1-buten-1-yl]phenyl hydrogen sulfate [ACD/IUPAC Name]
2-Hydroxy-5-[(1E)-3-oxo-1-buten-1-yl]phenylhydrogensulfat [German] [ACD/IUPAC Name]
3-Buten-2-one, 4-[4-hydroxy-3-(sulfooxy)phenyl]-, (3E)- [ACD/Index Name]
Hydrogénosulfate de 2-hydroxy-5-[(1E)-3-oxo-1-butén-1-yl]phényle [French] [ACD/IUPAC Name]

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: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.616
Molar Refractivity: 58.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): -4.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 168.5±3.0 cm3

Click to predict properties on the Chemicalize site


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