(4S,4Ar,8As)-4-[(E)-2-(3-Furyl)Vinyl]-3,4A,8,8-Tetramethyl-4A,5,6,7,8,8A-Hexahydro-1(4H)-Naphthalenone

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Properties Simple | Detailed

Formula C20H26O2
IUPAC Name (4s,4ar,8as)-4-[(e)-2-(3-furyl)vinyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4h-naphthalen-1-one
Molecular Mass 298.419 g·mol−1
Heat of Formation -241.8 ± 16.7 kJ·mol−1
Dipole Moment 3.90 ± 1.08 D
Volume 387.06 Å 3
Surface Area 317.43 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,4ar,8as)-4-[(e)-2-(3-furyl)vinyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4h-naphthalen-1-one
  • (4s,4ar,8as)-4-[(e)-2-furan-3-ylethenyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-4h-naphthalen-1-one
InChIKey MXTCKNHXBBXULO-ZJDHVTHPSA-N
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