Found 4 results

Search term: QMKCRYHPZVAORM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | sarcocrassocolide K | C20H28O4

sarcocrassocolide K

  • Molecular FormulaC20H28O4
  • Average mass332.434 Da
  • Monoisotopic mass332.198761 Da
  • ChemSpider ID27022391

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1aS,3E,5S,8E,10aS,13aR,14aS)-5-Hydroxy-1a,5,9-trimethyl-13-methylen-2,5,6,7,10,10a,13,13a,14,14a-decahydrooxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-on [German] [ACD/IUPAC Name]
(1aS,3E,5S,8E,10aS,13aR,14aS)-5-Hydroxy-1a,5,9-trimethyl-13-methylene-2,5,6,7,10,10a,13,13a,14,14a-decahydrooxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-one [ACD/IUPAC Name]
(1aS,3E,5S,8E,10aS,13aR,14aS)-5-Hydroxy-1a,5,9-triméthyl-13-méthylène-2,5,6,7,10,10a,13,13a,14,14a-décahydrooxiréno[4,5]cyclotétradéca[1,2-b]furan-12(1aH)-one [French] [ACD/IUPAC Name]
Oxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-one, 2,5,6,7,10,10a,13,13a,14,14a-decahydro-5-hydroxy-1a,5,9-trimethyl-13-methylene-, (1aS,3E,5S,8E,10aS,13aR,14aS)- [ACD/Index Name]
sarcocrassocolide K

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

Density: 1.1±0.1 g/cm3
Boiling Point: 496.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.0±6.0 kJ/mol
Flash Point: 172.6±22.2 °C
Index of Refraction: 1.548
Molar Refractivity: 92.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 294.06
ACD/KOC (pH 5.5): 2034.76
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 294.06
ACD/KOC (pH 7.4): 2034.76
Polar Surface Area: 59 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 43.3±5.0 dyne/cm
Molar Volume: 292.0±5.0 cm3

Click to predict properties on the Chemicalize site


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