4,5A-Epoxy-3,14-Dihydroxy-17-(2-Methoxyethyl)Morphinan-6-One

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Properties Simple | Detailed

Formula C19H23NO5
IUPAC Name (3r,4r,4as,7ar,12bs)-4a,9-dihydroxy-3-(2-methoxyethyl)-2,4,5,6,7a,13-hexahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one
Molecular Mass 345.390 g·mol−1
Heat of Formation -729.6 ± 16.7 kJ·mol−1
Dipole Moment 5.08 ± 1.08 D
Volume 394.58 Å 3
Surface Area 325.69 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (5alpha)-4,6-epoxy-3,14-dihydroxy-17-(2-methoxyethyl)morphinan-6-one
  • 4,5 alpha-epoxy-3,14-dihydroxy-17-(2-methoxyethyl)morphinan-6-one
  • mr 2264
  • mr 2264 cl
  • mr-2264
  • n-(2-methoxyethyl)noroxymorphone
  • semorphone
CAS Number(s)
  • 148708-26-3
  • 88939-40-6
InChIKey PBGIBLLOMGURPS-GRGSLBFTSA-N
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