ChemSpider 2D Image | (6S)-3,5-Dideoxy-5-(glycoloylamino)-6-[(1S,2S)-1,2,3-trihydroxypropyl]-alpha-D-threo-hex-2-ulopyranosonic acid | C11H19NO10

(6S)-3,5-Dideoxy-5-(glycoloylamino)-6-[(1S,2S)-1,2,3-trihydroxypropyl]-α-D-threo-hex-2-ulopyranosonic acid

  • Molecular FormulaC11H19NO10
  • Average mass325.269 Da
  • Monoisotopic mass325.100891 Da
  • ChemSpider ID61715507

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(6S)-3,5-Dideoxy-5-(glycoloylamino)-6-[(1S,2S)-1,2,3-trihydroxypropyl]-α-D-threo-hex-2-ulopyranosonic acid [ACD/IUPAC Name]
(6S)-3,5-Didesoxy-5-(glycoloylamino)-6-[(1S,2S)-1,2,3-trihydroxypropyl]-α-D-threo-hex-2-ulopyranosonsäure [German] [ACD/IUPAC Name]
Acide (6S)-3,5-didésoxy-5-[(2-hydroxyacétyl)amino]-6-[(1S,2S)-1,2,3-trihydroxypropyl]-α-D-thréo-hex-2-ulopyranosonique [French] [ACD/IUPAC Name]
L-glycero-β-L-galacto-2-Nonulopyranosonic acid, 3,5-dideoxy-5-[(2-hydroxyacetyl)amino]- [ACD/Index Name]
NGC

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 884.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 146.0±6.0 kJ/mol
Flash Point: 488.6±34.3 °C
Index of Refraction: 1.645
Molar Refractivity: 67.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -3.46
ACD/LogD (pH 5.5): -6.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 26.6±0.5 10-24cm3
Surface Tension: 113.5±5.0 dyne/cm
Molar Volume: 185.4±5.0 cm3

Click to predict properties on the Chemicalize site


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