Cas no 19328-35-9 (3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine)

3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine structure
19328-35-9 structure
Product Name:3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine
CAS No:19328-35-9
MF:C19H27NO3
MW:317.422585725784
CID:908029
PubChem ID:317154
Update Time:2025-04-19

3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine Chemical and Physical Properties

Names and Identifiers

    • 3-butyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-one
    • 3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine
    • 2-Oxo-3-butyl-9,10-dimethoxy-1,2,3,4,6,7-hexahydro-11bH-benzo< a> chinolizin
    • 3-Butyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2-oxo-2H-benzo< a> chinolizin
    • 3-Butyl-2-oxo-9,10-dimethoxy-1,2,3,4,6,7-hexahydro-11bH-benzo< a> chinolizin
    • 3-butyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-pyrido[2,1-a]isoquinolin-2-one
    • 9,10-Dimethoxy-2-oxo-3-butyl-1,2,3,4,6,7-hexahydro-11bH-benzo< a> chinolizin
    • NSC247052
    • SureCN4412539
    • 3-Butyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinolin-2-one
    • SCHEMBL4412539
    • E81429
    • 3-Butyl-9,10-dimethoxy-3,4,6,7-tetrahydro-1H-pyrido[2,1-a]isoquinolin-2(11bH)-one
    • NSC-247052
    • DTXSID20311903
    • CS-0114649
    • 3-Butyl-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2H-benzo[a]quinolizin-2-one; NSC 247052
    • 19328-35-9
    • Inchi: 1S/C19H27NO3/c1-4-5-6-14-12-20-8-7-13-9-18(22-2)19(23-3)10-15(13)16(20)11-17(14)21/h9-10,14,16H,4-8,11-12H2,1-3H3
    • InChI Key: CXDIPZOEHIFPBF-UHFFFAOYSA-N
    • SMILES: O=C1CC2C3C=C(C(=CC=3CCN2CC1CCCC)OC)OC

Computed Properties

  • Exact Mass: 317.19921
  • Monoisotopic Mass: 317.19909372g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 5
  • Complexity: 413
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 38.8?2

Experimental Properties

  • PSA: 38.77

3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine Security Information

3-Des(2-methylpropyl)-3-n-Butyl Tetrabenazine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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