ChemSpider 2D Image | Dodecyl b-D-thiomaltopyranoside | C24H46O10S

Dodecyl b-D-thiomaltopyranoside

  • Molecular FormulaC24H46O10S
  • Average mass526.681 Da
  • Monoisotopic mass526.281189 Da
  • ChemSpider ID9802592

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

148565-58-6 [RN]
4-O-α-D-Glucopyranosyl-1-thio-β-D-glucopyranoside de dodécyle [French] [ACD/IUPAC Name]
Dodecyl 4-O-α-D-glucopyranosyl-1-thio-β-D-glucopyranoside [ACD/IUPAC Name]
Dodecyl b-D-thiomaltopyranoside
Dodecyl-4-O-α-D-glucopyranosyl-1-thio-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, dodecyl 4-O-α-D-glucopyranosyl-1-thio- [ACD/Index Name]
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-6-dodecylsulfanyl-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6S)-6-(dodecylsulfanyl)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
[148565-58-6] [RN]
Dodecyl β-D-thiomaltopyranoside
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 730.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.8±6.0 kJ/mol
Flash Point: 395.9±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 132.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.53
ACD/KOC (pH 5.5): 943.75
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 100.53
ACD/KOC (pH 7.4): 943.74
Polar Surface Area: 195 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 403.8±5.0 cm3

Click to predict properties on the Chemicalize site


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