Cas no 154355-90-5 (2-Bromo-5-(phenylethynyl)thiophene)
154355-90-5 structure
Product Name:2-Bromo-5-(phenylethynyl)thiophene
CAS No:154355-90-5
MF:C12H7BrS
MW:263.152981042862
CID:2779275
PubChem ID:15459001
Update Time:2025-04-21
2-Bromo-5-(phenylethynyl)thiophene Chemical and Physical Properties
Names and Identifiers
-
- 154355-90-5
- DTXCID50523739
- 2-Bromo-5-(phenylethynyl)thiophene
- AKOS040764616
- DTXSID30572967
- SCHEMBL8305778
-
- Inchi： 1S/C12H7BrS/c13-12-9-8-11(14-12)7-6-10-4-2-1-3-5-10/h1-5,8-9H
- InChI Key： AZZHZGDOEHABIL-UHFFFAOYSA-N
- SMILES： BrC1=CC=C(C#CC2C=CC=CC=2)S1
Computed Properties
- Exact Mass: 261.94518Da
- Monoisotopic Mass: 261.94518Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 244
- 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: 4.7
- Topological Polar Surface Area: 28.2?2
2-Bromo-5-(phenylethynyl)thiophene Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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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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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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