Found 1 result

Search term: JBOYPUMMVUARRA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3S)-5-(3-Furyl)-7'-methyl-3',5',5a',7',8',8a'-hexahydrospiro[furan-3,6'-naphtho[1,8-bc]furan]-2,2'(4'H)-dione | C19H18O5

(3S)-5-(3-Furyl)-7'-methyl-3',5',5a',7',8',8a'-hexahydrospiro[furan-3,6'-naphtho[1,8-bc]furan]-2,2'(4'H)-dione

  • Molecular FormulaC19H18O5
  • Average mass326.343 Da
  • Monoisotopic mass326.115417 Da
  • ChemSpider ID30650552

  • defined stereocentres - 1 of 4 defined stereocentres

More details:

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

(3S)-5-(3-Furyl)-7'-methyl-3',5',5a',7',8',8a'-hexahydrospiro[furan-3,6'-naphtho[1,8-bc]furan]-2,2'(4'H)-dione [ACD/IUPAC Name]
Spiro[furan-3(2H),6'-[6H]naphtho[1,8-bc]furan]-2,2'(4'H)-dione, 5-(3-furanyl)-3',5',5'a,7',8',8'a-hexahydro-7'-methyl-, (3S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 620.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 328.9±31.5 °C
Index of Refraction: 1.619
Molar Refractivity: 83.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 305.92
ACD/KOC (pH 5.5): 2093.16
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 305.92
ACD/KOC (pH 7.4): 2093.16
Polar Surface Area: 66 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 237.4±5.0 cm3

Click to predict properties on the Chemicalize site


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