ChemSpider 2D Image | 1-Hydroxy-2-oxopropyl hydrogen sulfate | C3H6O6S

1-Hydroxy-2-oxopropyl hydrogen sulfate

  • Molecular FormulaC3H6O6S
  • Average mass170.141 Da
  • Monoisotopic mass169.988510 Da
  • ChemSpider ID109121251

More details:

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

1-Hydroxy-2-oxopropyl hydrogen sulfate [ACD/IUPAC Name]
1-Hydroxy-2-oxopropylhydrogensulfat [German] [ACD/IUPAC Name]
2-Propanone, 1-hydroxy-1-(sulfooxy)- [ACD/Index Name]
Hydrogénosulfate de 1-hydroxy-2-oxopropyle [French] [ACD/IUPAC Name]

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: 1.517
Molar Refractivity: 29.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.28
ACD/LogD (pH 5.5): -4.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 77.1±3.0 dyne/cm
Molar Volume: 98.0±3.0 cm3

Click to predict properties on the Chemicalize site


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