(4Ar,5R,6R,8Ar)-6-(Acetoxymethyl)-5-[2-(3-Furyl)Ethyl]-5,8A-Dimethyl-3,4,4A,5,6,7,8,8A-Octahydro-1-Naphthalenecarboxylic Acid

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Formula C22H30O5
IUPAC Name (4ar,5r,6r,8ar)-6-(acetoxymethyl)-5-[2-(3-furyl)ethyl]-5,8a-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
Molecular Mass 374.471 g·mol−1
Heat of Formation -906.1 ± 16.7 kJ·mol−1
Dipole Moment 2.37 ± 1.08 D
Volume 466.11 Å 3
Surface Area 376.85 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -0.00 ± eV
Point Group Symmetry C1
Synonyms
  • (4ar,5r,6r,8ar)-6-(acetoxymethyl)-5-[2-(3-furyl)ethyl]-5,8a-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
  • (4ar,5r,6r,8ar)-6-(acetyloxymethyl)-5-(2-furan-3-ylethyl)-5,8a-dimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
InChIKey CSQRHRPGMJMXPY-TZEULACYSA-N
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