Found 424 results

Search term: MF = 'C_{9}H_{8}O_{2}S_{2}'
ChemSpider 2D Image | 3-Methyl-4H-thieno[3,2-c]thiopyran-6-carboxylic acid | C9H8O2S2

3-Methyl-4H-thieno[3,2-c]thiopyran-6-carboxylic acid

  • Molecular FormulaC9H8O2S2
  • Average mass212.289 Da
  • Monoisotopic mass211.996567 Da
  • ChemSpider ID27453039

More details:

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

3-Methyl-4H-thieno[3,2-c]thiopyran-6-carbonsäure [German] [ACD/IUPAC Name]
3-Methyl-4H-thieno[3,2-c]thiopyran-6-carboxylic acid [ACD/IUPAC Name]
4H-Thieno[3,2-c]thiopyran-6-carboxylic acid, 3-methyl- [ACD/Index Name]
Acide 3-méthyl-4H-thiéno[3,2-c]thiopyrane-6-carboxylique [French] [ACD/IUPAC Name]
1281465-80-2 [RN]
MFCD16991154

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

Density: 1.5±0.1 g/cm3
Boiling Point: 398.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 194.6±27.9 °C
Index of Refraction: 1.691
Molar Refractivity: 55.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.56
ACD/LogD (pH 5.5): 0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.43
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 66.5±3.0 dyne/cm
Molar Volume: 145.0±3.0 cm3

Click to predict properties on the Chemicalize site


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