Found 4819 results

Search term: MF = 'C_{12}H_{22}N_{2}O_{4}S'
ChemSpider 2D Image | tert-Butyl 3-(1,1-dioxidothiomorpholino)azetidine-1-carboxylate | C12H22N2O4S

tert-Butyl 3-(1,1-dioxidothiomorpholino)azetidine-1-carboxylate

  • Molecular FormulaC12H22N2O4S
  • Average mass290.379 Da
  • Monoisotopic mass290.130035 Da
  • ChemSpider ID27475249

More details:

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

1257293-65-4 [RN]
1-Azetidinecarboxylic acid, 3-(1,1-dioxido-4-thiomorpholinyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(1,1-dioxido-4-thiomorpholinyl)-1-azetidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(1,1-dioxido-4-thiomorpholinyl)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
3-(1,1-Dioxydo-4-thiomorpholinyl)-1-azétidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 3-(1,1-dioxidothiomorpholino)azetidine-1-carboxylate
3-(1,1-Dioxo-1-thiomorpholine-4-yl)azetidine-1-carboxylic acid tert-butyl ester
3-(1,1-Dioxo-1-thiomorpholine-4-yl)azetidine-1-carboxylicacidtert-butylester
MFCD22370084 [MDL number]
tert-butyl 3-(1,1-dioxo-1,4-thiazinan-4-yl)azetidine-1-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 446.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 223.6±28.7 °C
Index of Refraction: 1.547
Molar Refractivity: 71.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.51
ACD/LogD (pH 5.5): -1.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.07
ACD/LogD (pH 7.4): -0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.31
Polar Surface Area: 75 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 227.0±3.0 cm3

Click to predict properties on the Chemicalize site


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