Cas no 65103-79-9 (Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl-)
65103-79-9 structure
Product Name:Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl-
CAS No:65103-79-9
MF:C14H14
MW:182.260963916779
CID:407340
PubChem ID:12469062
Update Time:2025-04-19
Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl-
- 1,2-diethynyl-3,4,5,6-tetramethylbenzene
- 65103-79-9
- DTXSID60499476
-
- Inchi: 1S/C14H14/c1-7-13-11(5)9(3)10(4)12(6)14(13)8-2/h1-2H,3-6H3
- InChI Key: UJAJIFFDSQRGPR-UHFFFAOYSA-N
- SMILES: C1(C)C(C)=C(C#C)C(C#C)=C(C)C=1C
Computed Properties
- Exact Mass: 182.10962
- Monoisotopic Mass: 182.109550447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 263
- 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: 3.9
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl- Related Literature
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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M. A. Piechowiak,A. Videcoq,R. Ferrando,D. Bochicchio,C. Pagnoux,F. Rossignol Phys. Chem. Chem. Phys., 2012,14, 1431-1439
65103-79-9 (Benzene, 1,2-diethynyl-3,4,5,6-tetramethyl-) Related Products
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