ChemSpider 2D Image | Methyl 2-S-beta-D-glucopyranosyl-2-thio-beta-L-glucopyranoside | C13H24O10S

Methyl 2-S-β-D-glucopyranosyl-2-thio-β-L-glucopyranoside

  • Molecular FormulaC13H24O10S
  • Average mass372.389 Da
  • Monoisotopic mass372.109009 Da
  • ChemSpider ID26329722

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-S-β-D-Glucopyranosyl-2-thio-β-L-glucopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2-S-β-D-glucopyranosyl-2-thio-β-L-glucopyranoside [ACD/IUPAC Name]
METHYL-2-S-(α-D-MANNOPYRANOSYL)-2-THIO-α-D-MANNOPYRANOSIDE
Methyl-2-S-β-D-glucopyranosyl-2-thio-β-L-glucopyranosid [German] [ACD/IUPAC Name]
β-L-Glucopyranoside, methyl 2-S-β-D-glucopyranosyl-2-thio- [ACD/Index Name]
(2S,3R,4S,5S,6R)-2-{[(2S,3S,4R,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]sulfanyl}-6-(hydroxymethyl)oxane-3,4,5-triol

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

Density: 1.6±0.1 g/cm3
Boiling Point: 684.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.9±6.0 kJ/mol
Flash Point: 368.0±31.5 °C
Index of Refraction: 1.644
Molar Refractivity: 81.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -2.18
ACD/LogD (pH 5.5): -2.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.18
ACD/LogD (pH 7.4): -2.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.18
Polar Surface Area: 195 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 93.5±5.0 dyne/cm
Molar Volume: 226.3±5.0 cm3

Click to predict properties on the Chemicalize site


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