ChemSpider 2D Image | 5-Hydroxy-7-(2-methylphenyl)-1,3-benzoxathiol-2-one | C14H10O3S

5-Hydroxy-7-(2-methylphenyl)-1,3-benzoxathiol-2-one

  • Molecular FormulaC14H10O3S
  • Average mass258.292 Da
  • Monoisotopic mass258.035065 Da
  • ChemSpider ID26405004

More details:

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

1,3-Benzoxathiol-2-one, 5-hydroxy-7-(2-methylphenyl)- [ACD/Index Name]
5-Hydroxy-7-(2-methylphenyl)-1,3-benzoxathiol-2-on [German] [ACD/IUPAC Name]
5-Hydroxy-7-(2-methylphenyl)-1,3-benzoxathiol-2-one [ACD/IUPAC Name]
5-Hydroxy-7-(2-méthylphényl)-1,3-benzoxathiol-2-one [French] [ACD/IUPAC Name]
1353501-83-3 [RN]
5-hydroxy-7-(2-methylphenyl)-2H-1,3-benzoxathiol-2-one
MFCD21090651
NS-03963

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

Density: 1.4±0.1 g/cm3
Boiling Point: 477.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 242.3±31.5 °C
Index of Refraction: 1.684
Molar Refractivity: 70.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 524.23
ACD/KOC (pH 5.5): 3076.28
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 461.64
ACD/KOC (pH 7.4): 2708.96
Polar Surface Area: 72 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 185.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement