Molecular structure of 2-Methyl-3-butenenitrile, CAS Number: 16529-56-9
2-Methyl-3-butenenitrile (CAS 16529-56-9)
Alternate Names:
3-Cyano-1-butene
CAS Number:
16529-56-9
Molecular Weight:
81.12
Molecular Formula:
C5H7N
Supplemental Information:
This is classified as a Dangerous Good for transport and may be subject to additional shipping charges.
For Research Use Only. Not Intended for Diagnostic or Therapeutic Use.
* Refer to Certificate of Analysis for lot specific data.
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SDS & Certificate of Analysis
2-Methyl-3-butenenitrile is a liquid ranging from colorless to yellowish and emits a sharp, pungent odor. It is an unsaturated nitrile compound that has important applications in various fields of research and industry. It exhibits minimal solubility in water but dissolves readily in organic solvents including ethanol, ether, acetone, and benzene. This compound serves as a precursor for the synthesis of various organic compounds such as α,ω-dinitriles, α,β- and β,γ-unsaturated nitriles, and heterocyclic entities. It′s also used as a ligand within the realm of organometallic chemistry and a starting material for the synthesis of high-performance polymers. Exposure to UV light induces radiation damage in this compound, making it an effective method for determining the structures of unknown compounds.
2-Methyl-3-butenenitrile (CAS 16529-56-9) References
- Solvent effects and activation parameters in the competitive cleavage of C-CN and C-H bonds in 2-methyl-3-butenenitrile using [(dippe)NiH]2. | Swartz, BD., et al. 2008. J Am Chem Soc. 130: 8548-54. PMID: 18540608
- Chiral Iodotriptycenes: Synthesis and Catalytic Applications. | Khan, N., et al. 2022. ChemistryOpen. 11: e202200145. PMID: 35822927
- Proposed molecular structures for 3-butenenitrile, 2-methyl-3-butenenitrile, and 3-methyl-3-butenenitrile☆ | D.A.C. Compton 1. March 1982,. Journal of Molecular Structure: THEOCHEM. Volume 87, Issue 1,: Pages 65-70.
- Catalytic Isomerization of 2-Methyl-3-butenenitrile by Nickel Systems Using Bis-diphosphinoferrocene Ligands: Evidence for Hemilability | Alberto Acosta-Ramírez, Miguel Muñoz-Hernández, William D. Jones, and Juventino J. García. 2007,. Organometallics. 26, 24, 5766–5769: 5766–5769.
- Nickel Complexes Involved in the Isomerization of 2-Methyl-3-butenenitrile | Alberto Acosta-Ramírez, Areli Flores-Gaspar, Miguel Muñoz-Hernández, Alma Arévalo, William D. Jones, and Juventino J. García. 2007,. Organometallics. 26, 7,: 1712–1720.
- P−C Bond Scission at the TRIPHOS Ligand and C−CN Bond Cleavage in 2-Methyl-3-butenenitrile with [Ni(COD)2] | Alberto Acosta-Ramírez†, Marcos Flores-Álamo†, William D. Jones‡, and Juventino J. García†*. 2008,. Organometallics. 27, 8,: 1834–1840.
- DFT Calculations of the Isomerization of 2-Methyl-3-butenenitrile by [Ni(bisphosphine)] in Relation to the DuPont Adiponitrile Process | Ting Li and William D. Jones*. 2011,. Organometallics. 30, 3,: 547–555.
- Vapor Pressure Measurement and Isobaric Vapor–Liquid Equilibria for Binary Mixtures of ZE-2-Methyl-2-butenenitrile and 2-Methyl-3-butenenitrile | Yu Cao†, Xuezhi Dai‡, Hang Song‡, Shun Yao‡, and Xianqiu Lan*‡. 2016. J. Chem. Eng. Data., 61, 4,: 1573–1577.
- Rational design of efficient steric catalyst for isomerization of 2-methyl-3-butenenitrile | Kaikai Liu, Tiefeng Wang, Minghan Han. December 2020,. Molecular Catalysis. Volume 498,: 111259.
- Reactivity of 2-methyl-3-butenenitrile in the presence of catalytic amounts of various cobalt complexes in ionic liquid | Vincent Lecocq a, Catherine C. Santini a, Yves Chauvin a, Jean-Marie Basset a, Jean-Christophe Galland b. 1 March 2006,. Journal of Molecular Catalysis A: Chemical. Volume 246, Issues 1–2,: Pages 242-247.
- Theoretical and experimental study of the nickel-catalyzed isomerization of 2-Methyl-3-butenenitrile and the effect of a Lewis acid | Kun Liu, Kai-Kai Liu, Mu-Jeng Cheng, Ming-Han Han. 1 November 2016,. Journal of Organometallic Chemistry. Volume 822,: Pages 29-38.
- Regioselective biocatalytic hydrolysis of (E,Z)-2-methyl-2-butenenitrile for production of (E)-2-methyl-2-butenoic acid | Eugenia C Hann, Amy E Sigmund, Susan K Fager, Frederick B Cooling, John E Gavagan, Michael G Bramucci, Sarita Chauhan, Mark S Payne, Robert DiCosimo. 12 January 2004,. Tetrahedron. Volume 60, Issue 3,: Pages 577-581.
- The catalytic isomerization reactions of 2-methyl-3-butenenitrile into 3-pentenenitrile in ionic liquids | Christophe Vallée a, Christine Valério a, Yves Chauvin a, Gerald P Niccolai a, Jean-Marie Basset a, Catherine C Santini a, Jean-Christophe Galland b 1, Blaise Didillon b. 18 May 2004,. Journal of Molecular Catalysis A: Chemical. Volume 214, Issue 1,: Pages 71-81.
Ordering Information
| Product Name | Catalog # | UNIT | Price | Qty | FAVORITES | |
2-Methyl-3-butenenitrile, 25 ml | sc-486090 | 25 ml | $47.00 |