ChemSpider 2D Image | (1,1-Dioxidotetrahydro-2H-thiopyran-4-yl)methanamine | C6H13NO2S

(1,1-Dioxidotetrahydro-2H-thiopyran-4-yl)methanamine

  • Molecular FormulaC6H13NO2S
  • Average mass163.238 Da
  • Monoisotopic mass163.066696 Da
  • ChemSpider ID25070582

More details:






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

(1,1-Dioxidotetrahydro-2H-thiopyran-4-yl)methanamine
[(1, 1-Dioxotetrahydro-2H-thiopyran-4-yl)methyl]amine
1-(1,1-Dioxidotetrahydro-2H-thiopyran-4-yl)methanamin [German] [ACD/IUPAC Name]
1-(1,1-Dioxidotetrahydro-2H-thiopyran-4-yl)methanamine [ACD/IUPAC Name]
1-(1,1-Dioxydotétrahydro-2H-thiopyrane-4-yl)méthanamine [French] [ACD/IUPAC Name]
2H-Thiopyran-4-methanamine, tetrahydro-, 1,1-dioxide [ACD/Index Name]
476660-77-2 [RN]
MFCD09864365 [MDL number]
(1, 1-Dioxotetrahydro-2H-thiopyran-4-yl)me thylamine
(1,1-Dioxothian-4-yl)methanamine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 353.3±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.8±3.0 kJ/mol
Flash Point: 167.5±20.4 °C
Index of Refraction: 1.495
Molar Refractivity: 40.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.23
ACD/LogD (pH 5.5): -4.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 69 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 137.8±3.0 cm3

Click to predict properties on the Chemicalize site






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