Cas no 116275-13-9 (2-bromo-N-(4-cyanophenyl)-2-methylpropanamide)
116275-13-9 structure
Product Name:2-bromo-N-(4-cyanophenyl)-2-methylpropanamide
CAS No:116275-13-9
MF:C11H11BrN2O
MW:267.121841669083
CID:2614416
PubChem ID:71338984
Update Time:2025-04-21
2-bromo-N-(4-cyanophenyl)-2-methylpropanamide Chemical and Physical Properties
Names and Identifiers
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- 2-bromo-N-(4-cyanophenyl)-2-methylpropanamide
- 116275-13-9
- DTXSID70766489
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- Inchi： 1S/C11H11BrN2O/c1-11(2,12)10(15)14-9-5-3-8(7-13)4-6-9/h3-6H,1-2H3,(H,14,15)
- InChI Key： GHPLLCSKUCXMIR-UHFFFAOYSA-N
- SMILES： BrC(C)(C)C(NC1C=CC(C#N)=CC=1)=O
Computed Properties
- Exact Mass: 266.00548Da
- Monoisotopic Mass: 266.00548Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 284
- 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: 52.9?2
2-bromo-N-(4-cyanophenyl)-2-methylpropanamide Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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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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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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