ChemSpider 2D Image | 13-(6-Deoxy-beta-L-mannopyranosyl)-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one | C26H23N3O5

13-(6-Deoxy-β-L-mannopyranosyl)-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one

  • Molecular FormulaC26H23N3O5
  • Average mass457.478 Da
  • Monoisotopic mass457.163757 Da
  • ChemSpider ID59701509

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

13-(6-Deoxy-β-L-mannopyranosyl)-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one [ACD/IUPAC Name]
13-(6-Desoxy-β-L-mannopyranosyl)-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-on [German] [ACD/IUPAC Name]
13-(6-Désoxy-β-L-mannopyranosyl)-6,7,12,13-tétrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one [French] [ACD/IUPAC Name]
5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one, 13-(6-deoxy-β-L-mannopyranosyl)-6,7,12,13-tetrahydro- [ACD/Index Name]
K252d

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

Density: 1.7±0.1 g/cm3
Boiling Point: 824.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 452.4±34.3 °C
Index of Refraction: 1.854
Molar Refractivity: 119.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 2.73
ACD/BCF (pH 5.5): 70.08
ACD/KOC (pH 5.5): 728.95
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 70.08
ACD/KOC (pH 7.4): 728.95
Polar Surface Area: 120 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 74.9±7.0 dyne/cm
Molar Volume: 266.0±7.0 cm3

Click to predict properties on the Chemicalize site


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