ChemSpider 2D Image | (2R,3R,4R,5R,2'S,3'S,4'S,5'S)-2,2'-[(4,5-Dimethyl-1,2-phenylene)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name) | C20H32N2O10

(2R,3R,4R,5R,2'S,3'S,4'S,5'S)-2,2'-[(4,5-Dimethyl-1,2-phenylene)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name)

  • Molecular FormulaC20H32N2O10
  • Average mass460.475 Da
  • Monoisotopic mass460.205688 Da
  • ChemSpider ID62401635

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2R,3R,4R,5R,2'S,3'S,4'S,5'S)-2,2'-[(4,5-Dimethyl-1,2-phenylen)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name) [German] [ACD/IUPAC Name]
(2R,3R,4R,5R,2'S,3'S,4'S,5'S)-2,2'-[(4,5-Dimethyl-1,2-phenylene)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name) [ACD/IUPAC Name]
(2R,3R,4R,5R,2'S,3'S,4'S,5'S)-2,2'-[(4,5-Diméthyl-1,2-phénylène)diimino]bis{5-[(1R)-1,2-dihydroxyéthyl]tétrahydro-3,4-furanediol} (non-preferred name) [French] [ACD/IUPAC Name]
(2S,3S,4S,5S,2'R,3'R,4'R,5'R)-2,2'-[(4,5-Dimethyl-1,2-phenylen)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name) [German] [ACD/IUPAC Name]
(2S,3S,4S,5S,2'R,3'R,4'R,5'R)-2,2'-[(4,5-Dimethyl-1,2-phenylene)diimino]bis{5-[(1R)-1,2-dihydroxyethyl]tetrahydro-3,4-furandiol} (non-preferred name) [ACD/IUPAC Name]
(2S,3S,4S,5S,2'R,3'R,4'R,5'R)-2,2'-[(4,5-Diméthyl-1,2-phénylène)diimino]bis{5-[(1R)-1,2-dihydroxyéthyl]tétrahydro-3,4-furanediol} (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 862.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.3±3.0 kJ/mol
Flash Point: 475.2±34.3 °C
Index of Refraction: 1.734
Molar Refractivity: 112.9±0.3 cm3
#H bond acceptors: 12
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -2.55
ACD/LogD (pH 5.5): -2.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.14
Polar Surface Area: 204 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 110.4±3.0 dyne/cm
Molar Volume: 281.7±3.0 cm3

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