Cas no 109374-15-4 (Piperazine,1-butyl-2-methyl-4-nitroso-)
109374-15-4 structure
Product Name:Piperazine,1-butyl-2-methyl-4-nitroso-
CAS No:109374-15-4
MF:C9H19N3O
MW:185.266661882401
CID:128406
PubChem ID:45115640
Update Time:2025-04-18
Piperazine,1-butyl-2-methyl-4-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- Piperazine,1-butyl-2-methyl-4-nitroso-
- 1-BUTYL-2-METHYL-4-NITROSOPIPERAZINE
- Piperazine, 1-butyl-2-methyl-4-nitroso- (9CI)
- DTXSID70668272
- 109374-15-4
-
- Inchi： 1S/C9H19N3O/c1-3-4-5-11-6-7-12(10-13)8-9(11)2/h9H,3-8H2,1-2H3
- InChI Key： UMDNICHBGYIWFS-UHFFFAOYSA-N
- SMILES： O=NN1CCN(CCCC)C(C)C1
Computed Properties
- Exact Mass: 185.15297
- Monoisotopic Mass: 185.153
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 163
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 35.9A^2
- XLogP3: 1.7
Experimental Properties
- PSA: 35.91
Piperazine,1-butyl-2-methyl-4-nitroso- Related Literature
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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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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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