ChemSpider 2D Image | Ethyl (2R)-{[(2-methyl-2-propanyl)sulfonyl]amino}(2,2,6-trimethyl-4-oxo-4H-1,3-dioxin-5-yl)acetate | C15H25NO7S

Ethyl (2R)-{[(2-methyl-2-propanyl)sulfonyl]amino}(2,2,6-trimethyl-4-oxo-4H-1,3-dioxin-5-yl)acetate

  • Molecular FormulaC15H25NO7S
  • Average mass363.427 Da
  • Monoisotopic mass363.135162 Da
  • ChemSpider ID30659010

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-{[(2-Méthyl-2-propanyl)sulfonyl]amino}(2,2,6-triméthyl-4-oxo-4H-1,3-dioxin-5-yl)acétate d'éthyle [French] [ACD/IUPAC Name]
4H-1,3-Dioxin-5-acetic acid, α-[[(1,1-dimethylethyl)sulfonyl]amino]-2,2,6-trimethyl-4-oxo-, ethyl ester, (αR)- [ACD/Index Name]
Ethyl (2R)-{[(2-methyl-2-propanyl)sulfonyl]amino}(2,2,6-trimethyl-4-oxo-4H-1,3-dioxin-5-yl)acetate [ACD/IUPAC Name]
Ethyl-(2R)-{[(2-methyl-2-propanyl)sulfonyl]amino}(2,2,6-trimethyl-4-oxo-4H-1,3-dioxin-5-yl)acetat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 493.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.3±31.5 °C
Index of Refraction: 1.489
Molar Refractivity: 86.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 14.15
ACD/KOC (pH 5.5): 231.74
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.24
ACD/KOC (pH 7.4): 200.54
Polar Surface Area: 116 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 300.7±3.0 cm3

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