Cas no 14947-20-7 ((2Z,4Z,6Z)-2,4,6-Octatriene)
(2Z,4Z,6Z)-2,4,6-Octatriene structure
Product Name:(2Z,4Z,6Z)-2,4,6-Octatriene
CAS No:14947-20-7
MF:C8H12
MW:108.180882453918
CID:2657258
PubChem ID:12533129
Update Time:2025-04-21
(2Z,4Z,6Z)-2,4,6-Octatriene Chemical and Physical Properties
Names and Identifiers
-
- (2Z,4Z,6Z)-2,4,6-Octatriene
- octa-2,4,6-triene
- (2E,4E,6E)-2,4,6-Octatriene #
- DTXSID10933653
- 14947-20-7
- 1,6-dimethyl-1,3,5-hexatriene
- DTXCID401362310
-
- Inchi： 1S/C8H12/c1-3-5-7-8-6-4-2/h3-8H,1-2H3/b5-3-,6-4-,8-7-
- InChI Key： CGMDPTNRMYIZTM-LPJDPMRYSA-N
- SMILES： C(/C=C\C)=C/C=C\C
Computed Properties
- Exact Mass: 108.093900383g/mol
- Monoisotopic Mass: 108.093900383g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 91.2
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 3
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 0?2
(2Z,4Z,6Z)-2,4,6-Octatriene Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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