Cas no 2363785-25-3 (methyl-d3 5-bromothiophene-2-carboxylate-3,4-d2)
2363785-25-3 structure
Product Name:methyl-d3 5-bromothiophene-2-carboxylate-3,4-d2
CAS No:2363785-25-3
MF:C6H5BrO2S
MW:226.102508306503
CID:6824793
PubChem ID:172402995
Update Time:2025-03-01
methyl-d3 5-bromothiophene-2-carboxylate-3,4-d2 Chemical and Physical Properties
Names and Identifiers
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- 2363785-25-3
- CS-22879
- methyl-d3 5-bromothiophene-2-carboxylate-3,4-d2
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- Inchi： 1S/C6H5BrO2S/c1-9-6(8)4-2-3-5(7)10-4/h2-3H,1H3/i1D3,2D,3D
- InChI Key： QLWUHAQCKDHUNL-RHIBPKLGSA-N
- SMILES： BrC1=C([2H])C([2H])=C(C(=O)OC([2H])([2H])[2H])S1
Computed Properties
- Exact Mass: 224.95075Da
- Monoisotopic Mass: 224.95075Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 140
- 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
methyl-d3 5-bromothiophene-2-carboxylate-3,4-d2 Related Literature
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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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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