ChemSpider 2D Image | (2S,3R,4R,5R)-4,5-Dihydroxy-2-(hydroxymethyl)-3-piperidinyl alpha-L-allopyranoside | C12H23NO9

(2S,3R,4R,5R)-4,5-Dihydroxy-2-(hydroxymethyl)-3-piperidinyl α-L-allopyranoside

  • Molecular FormulaC12H23NO9
  • Average mass325.312 Da
  • Monoisotopic mass325.137268 Da
  • ChemSpider ID29409144

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2S,3R,4R,5R)-4,5-Dihydroxy-2-(hydroxymethyl)-3-piperidinyl α-L-allopyranoside [ACD/IUPAC Name]
(2S,3R,4R,5R)-4,5-Dihydroxy-2-(hydroxymethyl)-3-piperidinyl-α-L-allopyranosid [German] [ACD/IUPAC Name]
α-L-Allopyranoside de (2S,3R,4R,5R)-4,5-dihydroxy-2-(hydroxyméthyl)-3-pipéridinyle [French] [ACD/IUPAC Name]
α-L-Allopyranoside, (2S,3R,4R,5R)-4,5-dihydroxy-2-(hydroxymethyl)-3-piperidinyl [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 628.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 106.6±6.0 kJ/mol
Flash Point: 333.9±31.5 °C
Index of Refraction: 1.642
Molar Refractivity: 71.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -4.45
ACD/LogD (pH 5.5): -5.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 172 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 98.7±5.0 dyne/cm
Molar Volume: 197.1±5.0 cm3

Click to predict properties on the Chemicalize site


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