Cas no 666735-69-9 (Ethanone, 2-bromo-1-(4-bromo-5-chloro-2-thienyl)-)
666735-69-9 structure
Product Name:Ethanone, 2-bromo-1-(4-bromo-5-chloro-2-thienyl)-
CAS No:666735-69-9
MF:C6H3Br2ClOS
MW:318.413418054581
CID:1711339
PubChem ID:23078425
Update Time:2025-04-21
Ethanone, 2-bromo-1-(4-bromo-5-chloro-2-thienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 2-bromo-1-(4-bromo-5-chloro-2-thienyl)-
- 2-Bromo-1-(4-bromo-5-chloro-2-thienyl)ethanone
- 666735-69-9
- DB-409194
- SCHEMBL3900686
-
- Inchi： 1S/C6H3Br2ClOS/c7-2-4(10)5-1-3(8)6(9)11-5/h1H,2H2
- InChI Key： YKFFVBPETVYVNG-UHFFFAOYSA-N
- SMILES： BrC1=C(SC(C(CBr)=O)=C1)Cl
Computed Properties
- Exact Mass: 315.79599
- Monoisotopic Mass: 315.79599g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 167
- 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: 4.1
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 17.07
Ethanone, 2-bromo-1-(4-bromo-5-chloro-2-thienyl)- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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N. Soin,D. Boyer,K. Prashanthi,S. Sharma,A. A. Narasimulu,J. Luo,T. H. Shah,E. Siores,T. Thundat Chem. Commun., 2015,51, 8257-8260
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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