Spiro(Estr-4-Ene-17,2'(3'H)-Furan)-3-One, 4',5'-Dihydro-, (17β)-

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Properties Simple | Detailed

Formula C21H30O2
IUPAC Name (8r,9s,10r,13s,14s,17r)-13-methylspiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-tetrahydrofuran]-3-one
Molecular Mass 314.462 g·mol−1
Heat of Formation -462.5 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 405.27 Å 3
Surface Area 327.02 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
Synonyms
  • (8r,9s,10r,13s,14s,17r)-13-methyl-3-spiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-tetrahydrofuran]one
  • (8r,9s,10r,13s,14s,17r)-13-methylspiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-oxolane]-3-one
  • (8r,9s,10r,13s,14s,17r)-13-methylspiro[1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-tetrahydrofuran]-3-one
  • l 586.153
  • spiro(estr-4-ene-17,2'(3'h)-furan)-3-one, 4',5'-dihydro-, (17r)-
CAS Number(s)
  • 1235-13-8
InChIKey UVAQHLGVSKJLTI-XUDSTZEESA-N
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