ChemSpider 2D Image | 1-(2,7-Bis{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanone (non-preferred name) | C35H39NO11

1-(2,7-Bis{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanone (non-preferred name)

  • Molecular FormulaC35H39NO11
  • Average mass649.684 Da
  • Monoisotopic mass649.252319 Da
  • ChemSpider ID72390995

More details:

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

1-(2,7-Bis{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethinyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanon (non-preferred name) [German] [ACD/IUPAC Name]
1-(2,7-Bis{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]ethynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)ethanone (non-preferred name) [ACD/IUPAC Name]
1-(2,7-Bis{[3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]éthynyl}-1'H-spiro[fluorene-9,4'-piperidin]-1'-yl)éthanone (non-preferred name) [French] [ACD/IUPAC Name]
1616113-45-1 [RN]
Antibiotic-202
D11825
Sibofimloc (USAN/INN)

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

Density: 1.6±0.1 g/cm3
Boiling Point: 993.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.8±3.0 kJ/mol
Flash Point: 554.7±34.3 °C
Index of Refraction: 1.735
Molar Refractivity: 165.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.45
ACD/KOC (pH 5.5): 616.05
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.45
ACD/KOC (pH 7.4): 616.04
Polar Surface Area: 201 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 102.9±5.0 dyne/cm
Molar Volume: 412.1±5.0 cm3

Click to predict properties on the Chemicalize site


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