ChemSpider 2D Image | 4,4-Dihydroxy-3-sulfo-3-butenoic acid | C4H6O7S

4,4-Dihydroxy-3-sulfo-3-butenoic acid

  • Molecular FormulaC4H6O7S
  • Average mass198.151 Da
  • Monoisotopic mass197.983429 Da
  • ChemSpider ID95661849

More details:

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

3-Butenoic acid, 4,4-dihydroxy-3-sulfo- [ACD/Index Name]
4,4-Dihydroxy-3-sulfo-3-butenoic acid [ACD/IUPAC Name]
4,4-Dihydroxy-3-sulfo-3-butensäure [German] [ACD/IUPAC Name]
Acide 4,4-dihydroxy-3-sulfo-3-buténoïque [French] [ACD/IUPAC Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 35.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.29
ACD/LogD (pH 5.5): -5.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 13.9±0.5 10-24cm3
Surface Tension: 133.3±3.0 dyne/cm
Molar Volume: 96.0±3.0 cm3

Click to predict properties on the Chemicalize site


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