ChemSpider 2D Image | Hydroxy(5-hydroxy-1,1-dioxido-1-benzothiophen-2-yl)acetic acid | C10H8O6S

Hydroxy(5-hydroxy-1,1-dioxido-1-benzothiophen-2-yl)acetic acid

  • Molecular FormulaC10H8O6S
  • Average mass256.232 Da
  • Monoisotopic mass256.004150 Da
  • ChemSpider ID74245380

More details:

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

Acide hydroxy(5-hydroxy-1,1-dioxydo-1-benzothiophén-2-yl)acétique [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-acetic acid, α,5-dihydroxy-, 1,1-dioxide [ACD/Index Name]
Hydroxy(5-hydroxy-1,1-dioxido-1-benzothiophen-2-yl)acetic acid [ACD/IUPAC Name]
Hydroxy(5-hydroxy-1,1-dioxido-1-benzothiophen-2-yl)essigsäure [German] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 681.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.0±3.0 kJ/mol
Flash Point: 366.1±31.5 °C
Index of Refraction: 1.722
Molar Refractivity: 56.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 120 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 98.0±3.0 dyne/cm
Molar Volume: 142.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement