Cas no 79917-02-5 (Thiophene,4-methyl-2-(1-propyn-1-yl)-)
79917-02-5 structure
Product Name:Thiophene,4-methyl-2-(1-propyn-1-yl)-
CAS No:79917-02-5
MF:C8H8S
MW:136.214120864868
CID:556890
Update Time:2024-01-30
Thiophene,4-methyl-2-(1-propyn-1-yl)- Chemical and Physical Properties
Names and Identifiers
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- Thiophene,4-methyl-2-(1-propyn-1-yl)-
- Thiophene,4-methyl-2-(1-propynyl)- (9CI)
- Thiophene, 4-methyl-2-(1-propynyl)- (9CI)
-
- Inchi： 1S/C8H8S/c1-3-4-8-5-7(2)6-9-8/h5-6H,1-2H3
- InChI Key： AOHOUCHECSVGRM-UHFFFAOYSA-N
- SMILES： C1(C#CC)SC=C(C)C=1
Computed Properties
- Exact Mass: 136.035
- Monoisotopic Mass: 136.035
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 148
- 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: 28.2A^2
Thiophene,4-methyl-2-(1-propyn-1-yl)- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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