ChemSpider 2D Image | (3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-Methyl-8-methylene-2-oxododecahydrooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl (2Z,2'E)bis(2-methyl-2-butenoate) | C24H30O7

(3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-Methyl-8-methylene-2-oxododecahydrooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl (2Z,2'E)bis(2-methyl-2-butenoate)

  • Molecular FormulaC24H30O7
  • Average mass430.491 Da
  • Monoisotopic mass430.199158 Da
  • ChemSpider ID23311270

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2Z,2'E)Bis(2-méthyl-2-buténoate) de (3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-méthyl-8-méthylène-2-oxododécahydrooxiréno[6,7]naphto[1,2-b]furane-3,6-diyle [French] [ACD/IUPAC Name]
(3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-Methyl-8-methylen-2-oxododecahydrooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl-(2Z,2'E)bis(2-methyl-2-butenoat) [German] [ACD/IUPAC Name]
(3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-Methyl-8-methylene-2-oxododecahydrooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl (2Z,2'E)bis(2-methyl-2-butenoate) [ACD/IUPAC Name]
(3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-5a-methyl-8-methylidene-2-oxododecahydrooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl (2Z,2'E)bis(2-methylbut-2-enoate)
2-Butenoic acid, 2-methyl-, (3R,3aR,5aS,6S,6aR,7aR,8aR,8bS)-dodecahydro-5a-methyl-8-methylene-2-oxooxireno[6,7]naphtho[1,2-b]furan-3,6-diyl ester, (2Z,2'E)- [ACD/Index Name]
2-methyl-but-2-enoic acid (3R,3aR,5aS,6S,8aR,8bS)-5a-methyl-6-(2-methyl-but-2-enoyloxy)-8-methylene-2-oxo-dodecahydro-1,7-dioxa-cyclopenta[a]cyclopropa[g]naphthalen-3-yl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 553.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 238.4±30.2 °C
Index of Refraction: 1.551
Molar Refractivity: 111.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 228.53
ACD/KOC (pH 5.5): 1698.76
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 228.53
ACD/KOC (pH 7.4): 1698.76
Polar Surface Area: 91 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 348.2±5.0 cm3

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