(3S,4R,4As,8As)-4-[2-(3-Furyl)Ethyl]-4-Hydroxy-3,4A,8,8-Tetramethyloctahydro-2(1H)-Naphthalenone

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Formula C20H30O3
IUPAC Name (3s,4r,4as,8as)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-decalin-2-one
Molecular Mass 318.450 g·mol−1
Heat of Formation -597.3 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 409.28 Å 3
Surface Area 325.13 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy 0.37 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4r,4as,8as)-4-(2-furan-3-ylethyl)-4-hydroxy-3,4a,8,8-tetramethyl-1,3,5,6,7,8a-hexahydronaphthalen-2-one
  • (3s,4r,4as,8as)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-2-decalinone
  • (3s,4r,4as,8as)-4-[2-(3-furyl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-decalin-2-one
  • hispanolone
CAS Number(s)
  • 18676-07-8
InChIKey UVKYPKNCQJIGKV-PEFDPPPMSA-N
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