ChemSpider 2D Image | 1,2-Thiazole-4-sulfonic acid | C3H3NO3S2

1,2-Thiazole-4-sulfonic acid

  • Molecular FormulaC3H3NO3S2
  • Average mass165.191 Da
  • Monoisotopic mass164.955429 Da
  • ChemSpider ID26635177

More details:

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

1,2-Thiazol-4-sulfonsäure [German] [ACD/IUPAC Name]
1,2-Thiazole-4-sulfonic acid [ACD/IUPAC Name]
4-Isothiazolesulfonic acid [ACD/Index Name]
Acide 1,2-thiazole-4-sulfonique [French] [ACD/IUPAC Name]
5995-46-0 [RN]
Isothiazole-4-sulfonic acid
MFCD17012829

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: 1.613
Molar Refractivity: 33.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.94
ACD/LogD (pH 5.5): -4.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 76.5±3.0 dyne/cm
Molar Volume: 94.9±3.0 cm3

Click to predict properties on the Chemicalize site


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