Cas no 21964-48-7 (1,12-Tridecadiene)
1,12-Tridecadiene structure
Product Name:1,12-Tridecadiene
1,12-Tridecadiene Chemical and Physical Properties
Names and Identifiers
-
- 1,12-Tridecadiene
- Tridecadiene-1,12
- trideca-1,12-diene
- DTXSID20176372
- BPHFKBMQSYYNGQ-UHFFFAOYSA-N
- AKOS006325203
- 21964-48-7
- CHEBI:151033
- NS00096186
-
- Inchi： 1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-4H,1-2,5-13H2
- InChI Key： BPHFKBMQSYYNGQ-UHFFFAOYSA-N
- SMILES： C(CCCCC=C)CCCCC=C
Computed Properties
- Exact Mass: 180.18792
- Monoisotopic Mass: 180.187801
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 10
- Complexity: 99.2
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0
- XLogP3: 6.2
Experimental Properties
- Density: 0.772
- Boiling Point: 225.2°C at 760 mmHg
- Flash Point: 78.4°C
- Refractive Index: 1.441
- PSA: 0
1,12-Tridecadiene Related Literature
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1. Liquid-crystalline perylene tetracarboxylic bisimide derivatives bearing cyclotetrasiloxane moietiesMasahiro Funahashi,Mika Yamaoka,Kaede Takenami,Akinari Sonoda J. Mater. Chem. C 2013 1 7872
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Xu Dong,Hui Wang,Hui Liu,Fagang Wang Org. Chem. Front. 2020 7 3530
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Man Vir Singh,Sudesh Kumar,Moinuddin Sarker Sustainable Energy Fuels 2018 2 1057
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