Found 71 results

Search term: MF = 'C_{11}H_{8}O_{5}S'
ChemSpider 2D Image | (1,1-Dioxido-4-oxo-4H-thiochromen-3-yl)methyl formate | C11H8O5S

(1,1-Dioxido-4-oxo-4H-thiochromen-3-yl)methyl formate

  • Molecular FormulaC11H8O5S
  • Average mass252.243 Da
  • Monoisotopic mass252.009247 Da
  • ChemSpider ID23239383

More details:

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

(1,1-Dioxido-4-oxo-4H-thiochromen-3-yl)methyl formate [ACD/IUPAC Name]
(1,1-Dioxido-4-oxo-4H-thiochromen-3-yl)methylformiat [German] [ACD/IUPAC Name]
4H-1-Benzothiopyran-4-one, 3-[(formyloxy)methyl]-, 1,1-dioxide [ACD/Index Name]
Formiate de (4-oxo-1,1-dioxydo-4H-thiochromén-3-yl)méthyle [French] [ACD/IUPAC Name]
Formic acid 1,1,4-trioxo-1,4-dihydro-1λ*6*-thiochromen-3-ylmethyl ester

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

Density: 1.5±0.1 g/cm3
Boiling Point: 460.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 232.5±28.7 °C
Index of Refraction: 1.597
Molar Refractivity: 58.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.83
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 2.43
ACD/KOC (pH 5.5): 65.68
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.43
ACD/KOC (pH 7.4): 65.68
Polar Surface Area: 86 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 171.9±3.0 cm3

Click to predict properties on the Chemicalize site


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