Cas no 623-35-8 (Butanedinitrile, methyl-)
Butanedinitrile, methyl- structure
Product Name:Butanedinitrile, methyl-
Butanedinitrile, methyl- Chemical and Physical Properties
Names and Identifiers
-
- Butanedinitrile, methyl-
- 2-methylbutanedinitrile
- 2-methylsuccinonitrile
- 1,2-dicyanopropane
- 623-35-8
- 2-methyl-butanedinitrile
- DTXSID80513769
-
- Inchi： 1S/C5H6N2/c1-5(4-7)2-3-6/h5H,2H2,1H3
- InChI Key： WEOKHGKSYLOTPP-UHFFFAOYSA-N
- SMILES： N#CC(C)CC#N
Computed Properties
- Exact Mass: 94.05318
- Monoisotopic Mass: 94.053098200g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 1
- Complexity: 131
- 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
- XLogP3: 0.2
- Topological Polar Surface Area: 47.6?2
Experimental Properties
- PSA: 47.58
Butanedinitrile, methyl- Related Literature
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1. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Lianqin Wang,Rachida Bance-Soualhi,Julia Ponce-González,Pilar Ocón,Edson A. Ticianelli,Daniel K. Whelligan,John R. Varcoe J. Mater. Chem. A, 2018,6, 24330-24341
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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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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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