Cas no 104759-77-5 (1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso-)

1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso- structure
104759-77-5 structure
Product Name:1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso-
CAS No:104759-77-5
MF:C11H13N3O2
MW:219.239822149277
CID:126410
PubChem ID:3122765
Update Time:2025-04-18

1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso- Chemical and Physical Properties

Names and Identifiers

    • 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso-
    • N-Nitrosocystisine
    • 3-Nitroso-1,2,3,4,5,6-hexahydro-1,5-methano-pyrido[1,2-a][1,5]diazocin-8-on
    • 3-Nitroso-1,2,3,4,5,6-hexahydro-1,5-methano-pyrido[1,2-a][1,5]diazocin-8-one
    • N-Nitroso-cytisin
    • N-Nitrosocytisine
    • BAS 00916425
    • FT-0701455
    • SR-01000316432-1
    • WAY-311980
    • 104759-77-5
    • 11-nitroso-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
    • AKOS000511298
    • SR-01000316432
    • DTXSID30389496
    • Inchi： 1S/C11H13N3O2/c15-11-3-1-2-10-9-4-8(6-14(10)11)5-13(7-9)12-16/h1-3,8-9H,4-7H2
    • InChI Key： VIMLBVWHEGYDNW-UHFFFAOYSA-N
    • SMILES： O=C1C=CC=C2C3CN(CC(CN21)C3)N=O

Computed Properties

  • Exact Mass: 219.10100
  • Monoisotopic Mass: 219.101
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 402
  • 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: 0.6
  • Topological Polar Surface Area: 53?2

Experimental Properties

  • PSA: 54.67000
  • LogP: 0.88670

1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso- Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso- Related Literature

Related Categories

104759-77-5 (1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one,1,2,3,4,5,6-hexahydro-3-nitroso-) Related Products

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