Return to Results (±)-Tetrabenazine
CAS Registry Number®
58-46-8
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CAS Name
(±)-TetrabenazineMolecular Formula
C19H27NO3Molecular Mass
317.42Cite this Page
(±)-Tetrabenazine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=58-46-8 (retrieved ) (CAS RN: 58-46-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
128 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16-/s2
InChIKey
InChIKey=MKJIEFSOBYUXJB-VTLFJGNJNA-N
SMILES
O(C)C=1C=C2[C@]3(N(C[C@H](CC(C)C)C(=O)C3)CCC2=CC1OC)[H]
Canonical SMILES
O=C1CC2C3=CC(OC)=C(OC)C=C3CCN2CC1CC(C)C
Other Names for this Substance
- 2H-Benzo[a]quinolizin-2-one, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-, (3R,11bR)-rel-
- 2H-Benzo[a]quinolizin-2-one, 1,3,4,6,7,11b-hexahydro-3-isobutyl-9,10-dimethoxy-
- 2H-Benzo[a]quinolizin-2-one, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-, cis-
- rel-(3R,11bR)-1,3,4,6,7,11b-Hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2H-benzo[a]quinolizin-2-one
- Ro 1-9569
Deleted or Replaced CAS Registry Numbers
2104-79-2, 39630-28-9
