Chemical Properties of Thebaine (CAS 115-37-7)

Thebaine

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InChI
InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3
InChI Key
FQXXSQDCDRQNQE-UHFFFAOYSA-N
Formula
C19H21NO3
SMILES
COc1ccc2c3c1OC1C(OC)=CC=C4C(C2)N(C)CCC341
Molecular Weight1
311.37
CAS
115-37-7
Other Names
  • Morphinan, 6,7,8,14-tetradehydro-4,5-epoxy-3,6-dimethoxy-17-methyl-, (5«alpha»)-
  • Morphinan, 6,7,8,14-tetradehydro-4,5«alpha»-epoxy-3,6-dimethoxy-17-methyl-
  • Paramorphine
  • Tebain
  • Thebain
Sources

Physical Properties

Property Value Unit Source
logPoct/wat 2.425 Crippen Calculated Property

Similar Compounds

Nalmefene, bis(trifluoroacetate). Neopine. Thebacon. Heptafluorobutyryl-codeine. 3-O,6-O,N-Triacetylnormorphine. 6-O,N-Diacetylnorcodeine. Codeinone, 14-hydroxy-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Etorphine. Naloxone, bis(trimethylsilyl) ether. Dipropanoylmorphine. 6-acetyl-3-propionyl-morphine. Morphine, diacetyl-, hydrochloride. Diacetylmorphine. ethylmorphine, propionic ester.

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