Cas no 648432-00-2 (Pyridine, 3,3'-(1,3,5,7-octatetrayne-1,8-diyl)bis-)
648432-00-2 structure
Product Name:Pyridine, 3,3'-(1,3,5,7-octatetrayne-1,8-diyl)bis-
CAS No:648432-00-2
MF:C18H8N2
MW:252.269523620605
CID:414665
PubChem ID:71378403
Update Time:2025-04-19
Pyridine, 3,3'-(1,3,5,7-octatetrayne-1,8-diyl)bis- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 3,3'-(1,3,5,7-octatetrayne-1,8-diyl)bis-
- 3-(8-pyridin-3-ylocta-1,3,5,7-tetraynyl)pyridine
- DTXSID50801024
- 3,3'-(Octa-1,3,5,7-tetrayne-1,8-diyl)dipyridine
- 1,8-di(3-pyridyl)octatetrayne
- 648432-00-2
-
- Inchi： 1S/C18H8N2/c1(3-5-9-17-11-7-13-19-15-17)2-4-6-10-18-12-8-14-20-16-18/h7-8,11-16H
- InChI Key： MBDDNIPENKKHII-UHFFFAOYSA-N
- SMILES： N1C=CC=C(C#CC#CC#CC#CC2C=NC=CC=2)C=1
Computed Properties
- Exact Mass: 252.068748264g/mol
- Monoisotopic Mass: 252.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 534
- 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
- XLogP3: 3
- Topological Polar Surface Area: 25.8?2
Pyridine, 3,3'-(1,3,5,7-octatetrayne-1,8-diyl)bis- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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