Cas no 132526-28-4 (2-Thiopheneacetic acid, 5-bromo-, ethyl ester)
132526-28-4 structure
Product Name:2-Thiopheneacetic acid, 5-bromo-, ethyl ester
CAS No:132526-28-4
MF:C8H9BrO2S
MW:249.124860525131
CID:3708520
PubChem ID:14792376
Update Time:2025-04-22
2-Thiopheneacetic acid, 5-bromo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiopheneacetic acid, 5-bromo-, ethyl ester
- ethyl 2-(5-bromothiophen-2-yl)acetate
- AT-51092
- ethyl (5-bromo-2-thienyl)acetate
- SCHEMBL5582083
- DB-171061
- AKOS017409156
- 132526-28-4
- KSIFJWDTXHYGDX-UHFFFAOYSA-N
-
- Inchi： 1S/C8H9BrO2S/c1-2-11-8(10)5-6-3-4-7(9)12-6/h3-4H,2,5H2,1H3
- InChI Key： KSIFJWDTXHYGDX-UHFFFAOYSA-N
- SMILES： C1(CC(OCC)=O)SC(Br)=CC=1
Computed Properties
- Exact Mass: 247.95066Da
- Monoisotopic Mass: 247.95066Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 163
- 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: 2.8
- Topological Polar Surface Area: 54.5?2
2-Thiopheneacetic acid, 5-bromo-, ethyl ester Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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