Cas no 106060-93-9 (4-Thiazolecarboxylicacid, 2-(2-bromoacetyl)-, ethyl ester)
106060-93-9 structure
Product Name:4-Thiazolecarboxylicacid, 2-(2-bromoacetyl)-, ethyl ester
CAS No:106060-93-9
MF:C8H8BrNO3S
MW:278.123020172119
CID:126992
PubChem ID:10934748
Update Time:2025-04-18
4-Thiazolecarboxylicacid, 2-(2-bromoacetyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazolecarboxylicacid, 2-(2-bromoacetyl)-, ethyl ester
- 4-Thiazolecarboxylicacid,2-(bromoacetyl)-,ethylester(9CI)
- ethyl 2-(2-bromoacetyl)-1,3-thiazole-4-carboxylate
- 4-thiazolecarboxylic acid,2-(bromoacetyl)-,ethyl ester
- 106060-93-9
-
- Inchi： 1S/C8H8BrNO3S/c1-2-13-8(12)5-4-14-7(10-5)6(11)3-9/h4H,2-3H2,1H3
- InChI Key： KBCJQASRMLVGID-UHFFFAOYSA-N
- SMILES： BrCC(C1=NC(C(=O)OCC)=CS1)=O
Computed Properties
- Exact Mass: 276.94083g/mol
- Monoisotopic Mass: 276.94083g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 237
- 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: 2.3
- Topological Polar Surface Area: 84.5?2
4-Thiazolecarboxylicacid, 2-(2-bromoacetyl)-, ethyl ester Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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