ChemSpider 2D Image | 6-Chloro-3-sulfanyl-4-pyridazinecarboxylic acid | C5H3ClN2O2S

6-Chloro-3-sulfanyl-4-pyridazinecarboxylic acid

  • Molecular FormulaC5H3ClN2O2S
  • Average mass190.607 Da
  • Monoisotopic mass189.960373 Da
  • ChemSpider ID74429553

More details:

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

4-Pyridazinecarboxylic acid, 6-chloro-3-mercapto- [ACD/Index Name]
6-Chlor-3-sulfanyl-4-pyridazincarbonsäure [German] [ACD/IUPAC Name]
6-Chloro-3-sulfanyl-4-pyridazinecarboxylic acid [ACD/IUPAC Name]
Acide 6-chloro-3-sulfanyl-4-pyridazinecarboxylique [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: 455.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 229.4±28.7 °C
Index of Refraction: 1.675
Molar Refractivity: 42.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): -1.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 84.1±3.0 dyne/cm
Molar Volume: 113.0±3.0 cm3

Click to predict properties on the Chemicalize site


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