ChemSpider 2D Image | tert-butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate | C15H27NO5

tert-butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate

  • Molecular FormulaC15H27NO5
  • Average mass301.379 Da
  • Monoisotopic mass301.188934 Da
  • ChemSpider ID23089793

More details:

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

220243-56-1 [RN]
2-Methyl-2-propanyl 5,6-anhydro-2,3,4-trideoxy-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)hexonate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5,6-anhydro-2,3,4-tridesoxy-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)hexonat [German] [ACD/IUPAC Name]
5,6-Anhydro-2,3,4-tridésoxy-2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)hexonate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Hexonic acid, 5,6-anhydro-2,3,4-trideoxy-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate
tert-butyl 5,6-anhydro-2-[(tert-butoxycarbonyl)amino]-2,3,4-trideoxyhexonate
tert-Butyl 2-((tert-butoxycarbonyl)amino)-4-(oxiran-2-yl)butanoate
TERT-BUTYL 2-[(TERT-BUTOXYCARBONYL)AMINO]-4-(OXIRAN-2-YL)BUTANOATE
TERT-BUTYL 2-{[(TERT-BUTOXY)CARBONYL]AMINO}-4-(OXIRAN-2-YL)BUTANOATE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 395.4±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 192.9±20.9 °C
Index of Refraction: 1.471
Molar Refractivity: 78.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 72.78
ACD/KOC (pH 5.5): 748.90
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 72.76
ACD/KOC (pH 7.4): 748.76
Polar Surface Area: 77 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 279.7±3.0 cm3

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