ChemSpider 2D Image | (1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynyl-8a,10a-dimethyl(6-~14~C)hexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol | C2114CH30O2

(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynyl-8a,10a-dimethyl(6-14C)hexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol

  • Molecular FormulaC2114CH30O2
  • Average mass328.465 Da
  • Monoisotopic mass328.227814 Da
  • ChemSpider ID8263459

  • defined stereocentres - 8 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethinyl-8a,10a-dimethyl(6-14C)hexadecahydrodicyclopenta[a,f]naphthalin-1,7-diol [German] [ACD/IUPAC Name]
(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diéthynyl-8a,10a-diméthyl(6-14C)hexadécahydrodicyclopenta[a,f]naphtalène-1,7-diol [French] [ACD/IUPAC Name]
(1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)-1,7-Diethynyl-8a,10a-dimethyl(6-14C)hexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol [ACD/IUPAC Name]
Dicyclopenta[a,f]naphthalene-1,7-diol-6-14C, 1,7-diethynylhexadecahydro-8a,10a-dimethyl-, (1R,3aS,3bR,5aS,7R,8aS,8bS,10aS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.580
Molar Refractivity: 94.4±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 283.5±5.0 cm3

Click to predict properties on the Chemicalize site


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