Cas no 62466-11-9 (Ethanone, 2-bromo-1-(3-methyl-2-thienyl)-)
62466-11-9 structure
Product Name:Ethanone, 2-bromo-1-(3-methyl-2-thienyl)-
CAS No:62466-11-9
MF:C7H7BrOS
MW:219.098880052567
CID:443941
PubChem ID:22731055
Update Time:2025-04-19
Ethanone, 2-bromo-1-(3-methyl-2-thienyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 2-bromo-1-(3-methyl-2-thienyl)-
- 2-bromo-1-(3-methylthiophen-2-yl)ethanone
- Ethanone, 2-bromo-1-(3-methyl-2-thienyl)- (9CI)
- FT-0751419
- 2-Bromo-1-(3-methylthiophen-2-yl)ethan-1-one
- 62466-11-9
- 2-bromo-1-(3-methylthiophen-2-yl)-ethanone
- DTXSID40627896
- AKOS010867546
- SCHEMBL5569894
- YUTFYMWVGAJBOG-UHFFFAOYSA-N
-
- Inchi： 1S/C7H7BrOS/c1-5-2-3-10-7(5)6(9)4-8/h2-3H,4H2,1H3
- InChI Key： YUTFYMWVGAJBOG-UHFFFAOYSA-N
- SMILES： BrCC(C1=C(C)C=CS1)=O
Computed Properties
- Exact Mass: 217.94011
- Monoisotopic Mass: 217.94010g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 138
- 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: 45.3?2
Experimental Properties
- PSA: 17.07
Ethanone, 2-bromo-1-(3-methyl-2-thienyl)- Related Literature
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1. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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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
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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