Cas no 17091-00-8 (1,3,5,11-Tridecatetraene-7,9-diyne,(E,E,E)- (8CI,9CI))
17091-00-8 structure
Product Name:1,3,5,11-Tridecatetraene-7,9-diyne,(E,E,E)- (8CI,9CI)
CAS No:17091-00-8
MF:C13H12
MW:168.234383583069
CID:173755
PubChem ID:5352698
Update Time:2025-04-19
1,3,5,11-Tridecatetraene-7,9-diyne,(E,E,E)- (8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5,11-Tridecatetraene-7,9-diyne,(E,E,E)- (8CI,9CI)
- (3E,5E,11E)-trideca-1,3,5,11-tetraen-7,9-diyne
- 1,3,5,11-Tridecatriene-7,9-diyne, (E,E,E)-
- (3E,5E,11E)-trideca-1,3,5,11-tetraene-7,9-diyne
- (E,E,E)-1,3,5,11-Tridecatetraene-7,9-diyne
- 1,3,5,11-Tridecatetraene-7,9-diyne
- CHEBI:172101
- 17091-00-8
- 1,3,5,11-Tridecatetraene-7,9-diyne isomer # 2
- 1,3,5,11-Tridecatetraene-7,9-diyne, (E,E,E)-
- 3,6-Bis[trichloromethyl]pyridazine
- 5-[p-Chlorobenzylidenamino]-2,4-dichlorobenzoic acid
- ASVIELUINMCNMW-FSNIPRKGSA-N
- 3E,5E,11E-Trideca-1,3,5,11-tetraene-7,9-diyne
- 2,4-Dichloro-5-([(E)-(4-chlorophenyl)methylidene]amino)benzoic acid
- DTXSID001257882
- 1,3(E),5(E),11(E)-Tridecatetraen-7,9-diyne
-
- Inchi： 1S/C13H12/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-7,9,11H,1H2,2H3/b6-4+,7-5+,11-9+
- InChI Key： ASVIELUINMCNMW-FSNIPRKGSA-N
- SMILES： C(/C=C/C#CC#C/C=C/C)=C\C=C
Computed Properties
- Exact Mass: 168.0939
- Monoisotopic Mass: 168.0939
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 350
- 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
- Topological Polar Surface Area: 0
- XLogP3: 4.2
Experimental Properties
- Density: 0.906
- Boiling Point: 292.4°C at 760 mmHg
- Flash Point: 122°C
- Refractive Index: 1.539
1,3,5,11-Tridecatetraene-7,9-diyne,(E,E,E)- (8CI,9CI) Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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3. 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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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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