ChemSpider 2D Image | tert-butyl 2-[(acetylsulfanyl)methyl]morpholine-4-carboxylate | C12H21NO4S

tert-butyl 2-[(acetylsulfanyl)methyl]morpholine-4-carboxylate

  • Molecular FormulaC12H21NO4S
  • Average mass275.364 Da
  • Monoisotopic mass275.119141 Da
  • ChemSpider ID30664111

More details:

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

2-[(Acétylsulfanyl)méthyl]-4-morpholinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-[(acetylsulfanyl)methyl]-4-morpholinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-[(acetylsulfanyl)methyl]-4-morpholincarboxylat [German] [ACD/IUPAC Name]
4-Morpholinecarboxylic acid, 2-[(acetylthio)methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
933477-81-7 [RN]
tert-butyl 2-[(acetylsulfanyl)methyl]morpholine-4-carboxylate
MFCD27982002
tert-butyl 2-[(acetylsulfanyl)methyl]-4-morpholinecarboxylate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 371.5±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 178.4±23.7 °C
Index of Refraction: 1.496
Molar Refractivity: 70.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.37
ACD/KOC (pH 5.5): 234.50
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.37
ACD/KOC (pH 7.4): 234.50
Polar Surface Area: 81 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

Click to predict properties on the Chemicalize site


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