Cas no 53984-90-0 (2-Bromo-N-(2,6-diethylphenyl)propanamide)
53984-90-0 structure
Product Name:2-Bromo-N-(2,6-diethylphenyl)propanamide
CAS No:53984-90-0
MF:C13H18BrNO
MW:284.192122936249
CID:2105105
Update Time:2023-08-03
2-Bromo-N-(2,6-diethylphenyl)propanamide Chemical and Physical Properties
Names and Identifiers
-
- 2-bromo-N-(2,6-diethylphenyl)Propanamide
- XYLPVIJOTOKAKQ-UHFFFAOYSA-N
- 2-bromo-2',6'-diethylpropionanilide
- 2-Bromo-N-(2,6-diethylphenyl)propanamide
-
- Inchi： 1S/C13H18BrNO/c1-4-10-7-6-8-11(5-2)12(10)15-13(16)9(3)14/h6-9H,4-5H2,1-3H3,(H,15,16)
- InChI Key： XYLPVIJOTOKAKQ-UHFFFAOYSA-N
- SMILES： BrC(C)C(NC1C(=CC=CC=1CC)CC)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 220
- XLogP3: 3
- Topological Polar Surface Area: 29.1
2-Bromo-N-(2,6-diethylphenyl)propanamide Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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