ChemSpider 2D Image | 4-(Sulfooxy)benzoic acid | C7H6O6S

4-(Sulfooxy)benzoic acid

  • Molecular FormulaC7H6O6S
  • Average mass218.184 Da
  • Monoisotopic mass217.988510 Da
  • ChemSpider ID30778498

More details:

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

4-(Sulfooxy)benzoesäure [German] [ACD/IUPAC Name]
4-(Sulfooxy)benzoic acid [ACD/IUPAC Name]
4-hydroxybenzoic acid-4-O-sulphate
Acide 4-(sulfooxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(sulfooxy)- [ACD/Index Name]
3233-38-3 [RN]
4-hydroxybenzoic acid 4-O-sulphate
4-sulfooxybenzoic 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: 1.623
Molar Refractivity: 45.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): -4.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 82.9±3.0 dyne/cm
Molar Volume: 128.0±3.0 cm3

Click to predict properties on the Chemicalize site


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