Cas no 4974-27-0 (2,6-Octadiene)
2,6-Octadiene structure
Product Name:2,6-Octadiene
2,6-Octadiene Chemical and Physical Properties
Names and Identifiers
-
- 2,6-Octadiene
- 1,6-Dimethyldiallyl
- 2,6-Octadien
- Octa-2,6-dien
- octa-2,6-diene
- Octadien-2,6
- trans,trans-octa-2,6-diene
- LAGGTOBQMQHXON-GGWOSOGESA-N
- 4974-27-0
- NSC 51709
- trans,trans-2,6-Octadiene
- trans-2,trans-6-octadiene
- (2E,6E)-octa-2,6-diene
- (2E,6E)-2,6-Octadiene
- AKOS006275137
- 2,6-Octadiene, (2E,6E)-
- 2,6-Octadiene, (E,E)-
-
- Inchi： 1S/C8H14/c1-3-5-7-8-6-4-2/h3-6H,7-8H2,1-2H3/b5-3+,6-4+
- InChI Key： LAGGTOBQMQHXON-GGWOSOGESA-N
- SMILES： C(/C=C/C)C/C=C/C
Computed Properties
- Exact Mass: 110.11000
- Monoisotopic Mass: 110.109550447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 66
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 2
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 0.7406
- Melting Point: -76°C
- Boiling Point: 126.55°C (estimate)
- Refractive Index: 1.4292
- PSA: 0.00000
- LogP: 2.91880
2,6-Octadiene Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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