ChemSpider 2D Image | 2-Hydroxy-5,7-dihydrothieno[3,4-b]pyridine-3-carboxylic acid 6,6-dioxide | C8H7NO5S

2-Hydroxy-5,7-dihydrothieno[3,4-b]pyridine-3-carboxylic acid 6,6-dioxide

  • Molecular FormulaC8H7NO5S
  • Average mass229.210 Da
  • Monoisotopic mass229.004486 Da
  • ChemSpider ID62001178

More details:






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

2-Hydroxy-5,7-dihydrothieno[3,4-b]pyridin-3-carbonsäure-6,6-dioxid [German] [ACD/IUPAC Name]
2-Hydroxy-5,7-dihydrothieno[3,4-b]pyridine-3-carboxylic acid 6,6-dioxide [ACD/IUPAC Name]
Acide 6,6-dioxyde de 2-hydroxy-5,7-dihydrothiéno[3,4-b]pyridine-3-carboxylique [French] [ACD/IUPAC Name]
Thieno[3,4-b]pyridine-3-carboxylic acid, 5,7-dihydro-2-hydroxy-, 6,6-dioxide [ACD/Index Name]
2090096-59-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 692.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.6±3.0 kJ/mol
Flash Point: 372.7±31.5 °C
Index of Refraction: 1.672
Molar Refractivity: 48.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.59
ACD/LogD (pH 5.5): -3.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 89.2±3.0 dyne/cm
Molar Volume: 129.3±3.0 cm3

Click to predict properties on the Chemicalize site






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