ChemSpider 2D Image | 2-Methyl-2-propanyl 4-{[1-(methoxyacetyl)-3-azetidinyl]sulfonyl}-1-piperazinecarboxylate | C15H27N3O6S

2-Methyl-2-propanyl 4-{[1-(methoxyacetyl)-3-azetidinyl]sulfonyl}-1-piperazinecarboxylate

  • Molecular FormulaC15H27N3O6S
  • Average mass377.456 Da
  • Monoisotopic mass377.162048 Da
  • ChemSpider ID30267191

More details:

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

1-Piperazinecarboxylic acid, 4-[[1-(2-methoxyacetyl)-3-azetidinyl]sulfonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-{[1-(methoxyacetyl)-3-azetidinyl]sulfonyl}-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{[1-(methoxyacetyl)-3-azetidinyl]sulfonyl}-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-{[1-(2-Méthoxyacétyl)-3-azétidinyl]sulfonyl}-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
TERT-BUTYL 4-[1-(2-METHOXYACETYL)AZETIDIN-3-YLSULFONYL]PIPERAZINE-1-CARBOXYLATE
TERT-BUTYL 4-{[1-(2-METHOXYACETYL)AZETIDIN-3-YL]SULFONYL}PIPERAZINE-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: 531.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±3.0 kJ/mol
Flash Point: 275.2±32.9 °C
Index of Refraction: 1.557
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.48
ACD/LogD (pH 5.5): -0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.20
ACD/LogD (pH 7.4): -0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 23.20
Polar Surface Area: 105 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 55.4±5.0 dyne/cm
Molar Volume: 284.3±5.0 cm3

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