Found 1 result

Search term: OC[C@@]1(O)CO[C@H](O)[C@@H]1O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | (2s,3r,4r)-4-(Hydroxymethyl)oxolane-2,3,4-Triol | C5H10O5

(2s,3r,4r)-4-(Hydroxymethyl)oxolane-2,3,4-Triol

  • Molecular FormulaC5H10O5
  • Average mass150.130 Da
  • Monoisotopic mass150.052826 Da
  • ChemSpider ID59051925

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2s,3r,4r)-4-(Hydroxymethyl)oxolane-2,3,4-Triol
(2S,3R,4R)-4-(Hydroxyméthyl)tétrahydro-2,3,4-furanetriol [French] [ACD/IUPAC Name]
(2S,3R,4R)-4-(Hydroxymethyl)tetrahydro-2,3,4-furantriol [German] [ACD/IUPAC Name]
(2S,3R,4R)-4-(Hydroxymethyl)tetrahydro-2,3,4-furantriol [ACD/IUPAC Name]
2,3,4-Furantriol, tetrahydro-4-(hydroxymethyl)-, (2S,3R,4R)- [ACD/Index Name]
30738-01-3 [RN]
XXM

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

Density: 1.7±0.1 g/cm3
Boiling Point: 364.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.6±6.0 kJ/mol
Flash Point: 174.1±27.9 °C
Index of Refraction: 1.624
Molar Refractivity: 31.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.11
ACD/LogD (pH 5.5): -2.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.82
ACD/LogD (pH 7.4): -2.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.82
Polar Surface Area: 90 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 90.3±3.0 dyne/cm
Molar Volume: 87.7±3.0 cm3

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