Cas no 144319-58-4 (3-Bromo-N-(2-oxothiolan-3-yl)propanamide)
144319-58-4 structure
Product Name:3-Bromo-N-(2-oxothiolan-3-yl)propanamide
CAS No:144319-58-4
MF:C7H10BrNO2S
MW:252.128799915314
CID:2106078
Update Time:2023-08-03
3-Bromo-N-(2-oxothiolan-3-yl)propanamide Chemical and Physical Properties
Names and Identifiers
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- 3-bromo-N-(tetrahydro-2-oxo-3-thienyl)Propanamide
- 3-Bromo-N-(2-oxothiolan-3-yl)propanamide
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- Inchi： 1S/C7H10BrNO2S/c8-3-1-6(10)9-5-2-4-12-7(5)11/h5H,1-4H2,(H,9,10)
- InChI Key： ZMIQUJDUYBRUNS-UHFFFAOYSA-N
- SMILES： BrCCC(NC1C(=O)SCC1)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 198
- XLogP3: 0.3
- Topological Polar Surface Area: 71.5
3-Bromo-N-(2-oxothiolan-3-yl)propanamide Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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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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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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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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