Found 62 results

Search term: MF = 'C_{35}H_{52}O_{5}'
ChemSpider 2D Image | hyphenrone A | C35H52O5

hyphenrone A

  • Molecular FormulaC35H52O5
  • Average mass552.784 Da
  • Monoisotopic mass552.381470 Da
  • ChemSpider ID34485462

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R,3S,4R,5R,7S)-5-Isobutyryl-4-methyl-1,3,7-tris(3-methyl-2-buten-1-yl)-4-(4-methyl-3-penten-1-yl)-8-oxabicyclo[5.2.1]decan-6,9,10-trion [German] [ACD/IUPAC Name]
(1R,3S,4R,5R,7S)-5-Isobutyryl-4-methyl-1,3,7-tris(3-methyl-2-buten-1-yl)-4-(4-methyl-3-penten-1-yl)-8-oxabicyclo[5.2.1]decane-6,9,10-trione [ACD/IUPAC Name]
(1R,3S,4R,5R,7S)-5-Isobutyryl-4-méthyl-1,3,7-tris(3-méthyl-2-butén-1-yl)-4-(4-méthyl-3-pentén-1-yl)-8-oxabicyclo[5.2.1]décane-6,9,10-trione [French] [ACD/IUPAC Name]
8-Oxabicyclo[5.2.1]decane-6,9,10-trione, 4-methyl-1,3,7-tris(3-methyl-2-buten-1-yl)-5-(2-methyl-1-oxopropyl)-4-(4-methyl-3-penten-1-yl)-, (1R,3S,4R,5R,7S)- [ACD/Index Name]
hyphenrone A

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

Density: 1.0±0.1 g/cm3
Boiling Point: 643.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 263.3±31.5 °C
Index of Refraction: 1.499
Molar Refractivity: 161.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 10.56
ACD/LogD (pH 5.5): 9.47
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3385078.00
ACD/LogD (pH 7.4): 9.46
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3312547.50
Polar Surface Area: 78 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 34.4±3.0 dyne/cm
Molar Volume: 550.1±3.0 cm3

Click to predict properties on the Chemicalize site


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