ChemSpider 2D Image | 1-(1,4-Dithian-2-ylmethyl)thiourea | C6H12N2S3

1-(1,4-Dithian-2-ylmethyl)thiourea

  • Molecular FormulaC6H12N2S3
  • Average mass208.368 Da
  • Monoisotopic mass208.016251 Da
  • ChemSpider ID42214728

More details:

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

1-(1,4-Dithian-2-ylmethyl)thioharnstoff [German] [ACD/IUPAC Name]
1-(1,4-Dithian-2-ylmethyl)thiourea [ACD/IUPAC Name]
1-(1,4-Dithian-2-ylméthyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-(1,4-dithian-2-ylmethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 373.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 179.7±27.3 °C
Index of Refraction: 1.650
Molar Refractivity: 58.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.28
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 2.55
ACD/KOC (pH 5.5): 68.09
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.55
ACD/KOC (pH 7.4): 68.09
Polar Surface Area: 121 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 160.5±3.0 cm3

Click to predict properties on the Chemicalize site


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