ChemSpider 2D Image | 1,6-Diamino-1,6-dideoxy-3,4-O-isopropylidene-D-mannitol | C9H20N2O4

1,6-Diamino-1,6-dideoxy-3,4-O-isopropylidene-D-mannitol

  • Molecular FormulaC9H20N2O4
  • Average mass220.266 Da
  • Monoisotopic mass220.142303 Da
  • ChemSpider ID110595669

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,6-Diamino-1,6-dideoxy-3,4-O-isopropylidene-D-mannitol [ACD/IUPAC Name]
1,6-Diamino-1,6-didesoxy-3,4-O-isopropyliden-D-mannitol [German] [ACD/IUPAC Name]
1,6-Diamino-1,6-didésoxy-3,4-O-isopropylidène-D-mannitol [French] [ACD/IUPAC Name]
D-Mannitol, 1,6-diamino-1,6-dideoxy-3,4-O-(1-methylethylidene)- [ACD/Index 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: 423.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±6.0 kJ/mol
Flash Point: 210.0±24.6 °C
Index of Refraction: 1.513
Molar Refractivity: 55.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.63
ACD/LogD (pH 5.5): -5.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 48.8±3.0 dyne/cm
Molar Volume: 182.8±3.0 cm3

Click to predict properties on the Chemicalize site


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