Cas no 36664-10-5 (N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide)
![N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide structure](https://ossimg.kuujia.com/scimg/37000/36664-10-5x500.png)
36664-10-5 structure
Product Name:N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide
CAS No:36664-10-5
MF:C7H10N4O3
MW:198.179300785065
CID:318485
PubChem ID:329736
Update Time:2025-04-19
N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide Chemical and Physical Properties
Names and Identifiers
-
- N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide
- AC1L75ED
- AG-F-28052
- CTK1C5906
- N-[2-(2-nitro-imidazol-1-yl)-ethyl]-acetamide
- N-< 2-(2-Nitro-1-imidazolyl)aethyl> acetamid
- N-< 2-(2-Nitro-1-imidazolyl)ethyl> acetamid
- NSC314053
- NSC-314053
- DTXSID90317295
- 36664-10-5
-
- Inchi： 1S/C7H10N4O3/c1-6(12)8-2-4-10-5-3-9-7(10)11(13)14/h3,5H,2,4H2,1H3,(H,8,12)
- InChI Key： CBTWZSITICYTDZ-UHFFFAOYSA-N
- SMILES： O=C(C)NCCN1C=CN=C1[N+](=O)[O-]
Computed Properties
- Exact Mass: 198.0754
- Monoisotopic Mass: 198.075
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 228
- 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: _0.5
- Topological Polar Surface Area: 92.7?2
Experimental Properties
- Density: 1.42
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.618
- PSA: 90.06
- LogP: 0.84150
N-[2-(2-nitroimidazol-1-yl)ethyl]acetamide Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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