Cas no 197957-65-6 (Thiophene, 3,3'-(1,2-ethynediyl)bis-)
197957-65-6 structure
Product Name:Thiophene, 3,3'-(1,2-ethynediyl)bis-
CAS No:197957-65-6
MF:C10H6S2
MW:190.284639835358
CID:1389412
PubChem ID:11401258
Update Time:2025-04-20
Thiophene, 3,3'-(1,2-ethynediyl)bis- Chemical and Physical Properties
Names and Identifiers
-
- Thiophene, 3,3'-(1,2-ethynediyl)bis-
- 3-(2-thiophen-3-ylethynyl)thiophene
- SCHEMBL22733866
- DTXSID20464701
- di(3-thienyl)ethyne
- 197957-65-6
-
- Inchi： 1S/C10H6S2/c1(9-3-5-11-7-9)2-10-4-6-12-8-10/h3-8H
- InChI Key： HHQGKRAXRSELOL-UHFFFAOYSA-N
- SMILES： S1C=CC(C#CC2=CSC=C2)=C1
Computed Properties
- Exact Mass: 189.99118
- Monoisotopic Mass: 189.99109254g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 190
- 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: 3.3
- Topological Polar Surface Area: 56.5?2
Experimental Properties
- PSA: 0
Thiophene, 3,3'-(1,2-ethynediyl)bis- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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