ChemSpider 2D Image | galactopinitol A | C13H24O11

galactopinitol A

  • Molecular FormulaC13H24O11
  • Average mass356.323 Da
  • Monoisotopic mass356.131866 Da
  • ChemSpider ID30777348

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(1S,2S,3R,4S,5R,6S)-2,3,4,6-Tetrahydroxy-5-methoxycyclohexyl α-D-galactopyranoside [ACD/IUPAC Name]
(1S,2S,3R,4S,5R,6S)-2,3,4,6-Tetrahydroxy-5-methoxycyclohexyl-α-D-galactopyranosid [German] [ACD/IUPAC Name]
64290-91-1 [RN]
galactopinitol A
α-D-Galactopyranoside de (1S,2S,3R,4S,5R,6S)-2,3,4,6-tétrahydroxy-5-méthoxycyclohexyle [French] [ACD/IUPAC Name]
α-D-Galactopyranoside, (1S,2S,3R,4S,5R,6S)-2,3,4,6-tetrahydroxy-5-methoxycyclohexyl [ACD/Index Name]
<i>O</i>;-&α;-D-galactopyranosyl-(1->2)-4-<i>O</i>-methyl-<i&gt;chiro</i>-inositol
(1S,2R,3S,4R,5S,6S)-4-methoxy-6-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexane-1,2,3,5-tetrol
2-O-α-D-Galactopyranoside 3-O-Methyl-D-chiro-inositol
2-O-α-D-Galactopyranoside 4-O-Methyl-D-chiro-inositol
More...

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

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

Density: 1.7±0.1 g/cm3
Boiling Point: 623.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.9±6.0 kJ/mol
Flash Point: 330.9±31.5 °C
Index of Refraction: 1.636
Molar Refractivity: 75.4±0.4 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -3.07
ACD/LogD (pH 5.5): -3.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 190 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 100.5±5.0 dyne/cm
Molar Volume: 210.5±5.0 cm3

Click to predict properties on the Chemicalize site


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