Cas no 81569-31-5 (5-Thiazolecarboxylicacid, 2-bromo-4-(1,1-dimethylethyl)-, ethyl ester)
81569-31-5 structure
Product Name:5-Thiazolecarboxylicacid, 2-bromo-4-(1,1-dimethylethyl)-, ethyl ester
CAS No:81569-31-5
MF:C10H14BrNO2S
MW:292.192660808563
CID:708119
PubChem ID:824449
Update Time:2025-04-19
5-Thiazolecarboxylicacid, 2-bromo-4-(1,1-dimethylethyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 5-Thiazolecarboxylicacid, 2-bromo-4-(1,1-dimethylethyl)-, ethyl ester
- 5-Thiazolecarboxylicacid,2-bromo-4-(1,1-dimethylethyl)-,ethylester(9CI)
- Ethyl 2-bromo-4-(2-methyl-2-propanyl)-1,3-thiazole-5-carboxylate
- ethyl 4-tert-butyl-2-bromothiazole-5-carboxylate
- ethyl 2-bromo-4-(tert-butyl)thiazole-5-carboxylate
- 81569-31-5
- FT-0749840
- AB-601/30965040
- ethyl 2-bromo-4-tert-butyl-1,3-thiazole-5-carboxylate
-
- Inchi： 1S/C10H14BrNO2S/c1-5-14-8(13)6-7(10(2,3)4)12-9(11)15-6/h5H2,1-4H3
- InChI Key： MUOIPOVBSDDTJN-UHFFFAOYSA-N
- SMILES： BrC1=NC(=C(C(=O)OCC)S1)C(C)(C)C
Computed Properties
- Exact Mass: 290.99286g/mol
- Monoisotopic Mass: 290.99286g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 242
- 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: 4.2
- Topological Polar Surface Area: 67.4?2
5-Thiazolecarboxylicacid, 2-bromo-4-(1,1-dimethylethyl)-, ethyl ester Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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