ChemSpider 2D Image | O-1-Benzothiophen-6-yl carbonochloridothioate | C9H5ClOS2

O-1-Benzothiophen-6-yl carbonochloridothioate

  • Molecular FormulaC9H5ClOS2
  • Average mass228.718 Da
  • Monoisotopic mass227.947037 Da
  • ChemSpider ID30916128

More details:

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

Carbonochloridothioate de O-1-benzothiophén-6-yle [French] [ACD/IUPAC Name]
Carbonochloridothioic acid, O-benzo[b]thien-6-yl ester [ACD/Index Name]
O-1-Benzothiophen-6-yl carbonochloridothioate [ACD/IUPAC Name]
O-1-Benzothiophen-6-ylcarbonochloridothioat [German] [ACD/IUPAC Name]
1-BENZOTHIOPHEN-6-YL CHLOROMETHANETHIOATE
83508-55-8 [RN]
carbonochloridothioic acid,o-benzo[b]thien-6-yl ester
MFCD27992863

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

Density: 1.5±0.1 g/cm3
Boiling Point: 336.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 157.2±20.4 °C
Index of Refraction: 1.731
Molar Refractivity: 61.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1052.80
ACD/KOC (pH 5.5): 5069.85
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1052.80
ACD/KOC (pH 7.4): 5069.85
Polar Surface Area: 70 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 65.2±3.0 dyne/cm
Molar Volume: 153.4±3.0 cm3

Click to predict properties on the Chemicalize site


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