Cas no 83817-42-9 ((7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate)
83817-42-9 structure
Product Name:(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate
CAS No:83817-42-9
MF:C15H25ClN2O6
MW:364.821803808212
CID:733143
PubChem ID:44151681
Update Time:2025-04-19
(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate Chemical and Physical Properties
Names and Identifiers
-
- (7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate
- [7R-(7alpha,7abeta,9beta,14alpha,14alpha)]-dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one monoperchlorate
- (7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one monoperchlorate
- 83817-42-9
- EINECS 280-943-4
-
- Inchi: 1S/C15H24N2O2.ClHO4/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19;2-1(3,4)5/h10-14,18H,1-9H2;2H/t10-,11-,12-,13-,14-;/m1./s1
- InChI Key: AORVUXJQKLVFSJ-XAWYEFCRSA-N
- SMILES: [Cl+3]([O-])([O-])([O-])O.O[C@@H]1CCN2C[C@@H]3[C@H]4CCCC(N4C[C@@H](C3)[C@H]2C1)=O
Computed Properties
- Exact Mass: 364.1401142g/mol
- Monoisotopic Mass: 364.1401142g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 24
- Rotatable Bond Count: 0
- Complexity: 500
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 115?2
(7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
83817-42-9 ((7R-(7alpha,7abeta,9beta,14alpha,14aalpha))-Dodecahydro-9-hydroxy-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate) Related Products
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