ChemSpider 2D Image | (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-Pentahydroxycyclohexyl alpha-D-galactopyranoside | C12H22O11

(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-Pentahydroxycyclohexyl α-D-galactopyranoside

  • Molecular FormulaC12H22O11
  • Average mass342.297 Da
  • Monoisotopic mass342.116211 Da
  • ChemSpider ID21403078

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-Pentahydroxycyclohexyl α-D-galactopyranoside [ACD/IUPAC Name]
(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-Pentahydroxycyclohexyl-α-D-galactopyranosid [German] [ACD/IUPAC Name]
3687-64-7 [RN]
α-D-Galactopyranoside de (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyle [French] [ACD/IUPAC Name]
α-D-Galactopyranoside, (1α,2α,3α,4β,5α,6β)-2,3,4,5,6-pentahydroxycyclohexyl [ACD/Index Name]
(1R,2R,4S,5R)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol
16908-86-4 [RN]
D-myo-Inositol, 1-O-&α;-D-galactopyranosyl-
galactinol
inositol, 1-O-&α;-D-galactopyranosyl-, myo-
More...

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

Density: 1.8±0.1 g/cm3
Boiling Point: 609.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 103.9±6.0 kJ/mol
Flash Point: 322.7±31.5 °C
Index of Refraction: 1.686
Molar Refractivity: 70.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 9
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -3.81
ACD/LogD (pH 5.5): -3.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 201 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 127.2±5.0 dyne/cm
Molar Volume: 185.5±5.0 cm3

Click to predict properties on the Chemicalize site


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