ChemSpider 2D Image | (5R,7R,8S,9S,10R)-7-(Hydroxymethyl)-3-phenyl-1,6-dioxa-2-azaspiro[4.5]dec-2-ene-8,9,10-triol | C14H17NO6

(5R,7R,8S,9S,10R)-7-(Hydroxymethyl)-3-phenyl-1,6-dioxa-2-azaspiro[4.5]dec-2-ene-8,9,10-triol

  • Molecular FormulaC14H17NO6
  • Average mass295.288 Da
  • Monoisotopic mass295.105591 Da
  • ChemSpider ID24648469

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(5R,7R,8S,9S,10R)-7-(Hydroxymethyl)-3-phenyl-1,6-dioxa-2-azaspiro[4.5]dec-2-en-8,9,10-triol [German] [ACD/IUPAC Name]
(5R,7R,8S,9S,10R)-7-(Hydroxymethyl)-3-phenyl-1,6-dioxa-2-azaspiro[4.5]dec-2-ene-8,9,10-triol [ACD/IUPAC Name]
(5R,7R,8S,9S,10R)-7-(Hydroxyméthyl)-3-phényl-1,6-dioxa-2-azaspiro[4.5]déc-2-ène-8,9,10-triol [French] [ACD/IUPAC Name]
1,6-Dioxa-2-azaspiro[4.5]dec-2-ene-8,9,10-triol, 7-(hydroxymethyl)-3-phenyl-, (5R,7R,8S,9S,10R)- [ACD/Index Name]
glucopyranosylidene-spiro-isoxazoline, 4c

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

Density: 1.6±0.1 g/cm3
Boiling Point: 539.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.0±3.0 kJ/mol
Flash Point: 280.2±32.9 °C
Index of Refraction: 1.673
Molar Refractivity: 69.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.28
ACD/KOC (pH 5.5): 114.60
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.28
ACD/KOC (pH 7.4): 114.60
Polar Surface Area: 112 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 65.9±7.0 dyne/cm
Molar Volume: 184.7±7.0 cm3

Click to predict properties on the Chemicalize site


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