ChemSpider 2D Image | 4-Amino-1,3,4,5-tetradeoxy-6-O-methyl-2-O-(2-methyl-2-propanyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-D-glycero-hexitol | C16H34N2O4

4-Amino-1,3,4,5-tetradeoxy-6-O-methyl-2-O-(2-methyl-2-propanyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-D-glycero-hexitol

  • Molecular FormulaC16H34N2O4
  • Average mass318.452 Da
  • Monoisotopic mass318.251862 Da
  • ChemSpider ID98396737

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

4-Amino-1,3,4,5-tetradeoxy-6-O-methyl-2-O-(2-methyl-2-propanyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-D-glycero-hexitol [ACD/IUPAC Name]
4-Amino-1,3,4,5-tetradesoxy-6-O-methyl-2-O-(2-methyl-2-propanyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-D-glycero-hexitol [German] [ACD/IUPAC Name]
4-Amino-1,3,4,5-tétradésoxy-6-O-méthyl-2-O-(2-méthyl-2-propanyl)-3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-D-glycéro-hexitol [French] [ACD/IUPAC Name]
D-glycero-Hexitol, 4-amino-1,3,4,5-tetradeoxy-3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-O-(1,1-dimethylethyl)-6-O-methyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 411.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 202.6±28.7 °C
Index of Refraction: 1.460
Molar Refractivity: 88.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): -0.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 1.41
ACD/KOC (pH 7.4): 17.09
Polar Surface Area: 83 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 32.8±3.0 dyne/cm
Molar Volume: 322.6±3.0 cm3

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