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Search term: 78441773 (Found by CSID)
ChemSpider 2D Image | (2S,3a'S,5S,6a'S)-5-(2-Hydroxyethyl)hexahydro-3H,5'H-spiro[furan-2,2'-furo[3,2-b]furan]-5'-one | C11H16O5

(2S,3a'S,5S,6a'S)-5-(2-Hydroxyethyl)hexahydro-3H,5'H-spiro[furan-2,2'-furo[3,2-b]furan]-5'-one

  • Molecular FormulaC11H16O5
  • Average mass228.242 Da
  • Monoisotopic mass228.099777 Da
  • ChemSpider ID78441773

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3a'S,5S,6a'S)-5-(2-Hydroxyethyl)hexahydro-3H,5'H-spiro[furan-2,2'-furo[3,2-b]furan]-5'-one [ACD/IUPAC Name]
Spiro[furan-2(3H),2'(5'H)-furo[3,2-b]furan]-5'-one, hexahydro-5-(2-hydroxyethyl)-, (2S,3a'S,5S,6a'S)- [ACD/Index Name]
cephalosporolide J

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

Density: 1.3±0.1 g/cm3
Boiling Point: 444.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±6.0 kJ/mol
Flash Point: 178.1±22.2 °C
Index of Refraction: 1.545
Molar Refractivity: 53.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.45
ACD/LogD (pH 5.5): -0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.73
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.73
Polar Surface Area: 65 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 169.8±5.0 cm3

Click to predict properties on the Chemicalize site


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