Cas no 2735-57-1 (1-(6-nitro-1H-benzimidazol-2-yl)-Ethanone)
2735-57-1 structure
Product Name:1-(6-nitro-1H-benzimidazol-2-yl)-Ethanone
CAS No:2735-57-1
MF:C9H7N3O3
MW:205.170181512833
CID:1110175
PubChem ID:12839163
Update Time:2025-04-20
1-(6-nitro-1H-benzimidazol-2-yl)-Ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-(6-nitro-1H-benzimidazol-2-yl)-Ethanone
- DTXSID40511165
- 1-(6-nitro-1H-benzimidazol-2-yl)ethanone
- 1-(5-nitro-1H-benzo[d]imidazol-2-yl)-1-ethanone
- 2735-57-1
- 1-(6-Nitro-1H-benzimidazol-2-yl)ethan-1-one
- InChI=1/C9H7N3O3/c1-5(13)9-10-7-3-2-6(12(14)15)4-8(7)11-9/h2-4H,1H3,(H,10,11
- Ethanone, 1-(5-nitro-1H-benzimidazol-2-yl)-
- 2-Acetyl-5-nitrobenzimidazole
- 1-(5-Nitro-1H-benzo[d]imidazol-2-yl)ethanone
-
- Inchi： 1S/C9H7N3O3/c1-5(13)9-10-7-3-2-6(12(14)15)4-8(7)11-9/h2-4H,1H3,(H,10,11)
- InChI Key： JZAPHKVAZSZGNL-UHFFFAOYSA-N
- SMILES： O=C(C)C1=NC2C=CC(=CC=2N1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 205.04874109g/mol
- Monoisotopic Mass: 205.04874109g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 289
- 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: 1.3
- Topological Polar Surface Area: 91.6?2
1-(6-nitro-1H-benzimidazol-2-yl)-Ethanone Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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