Cas no 36664-11-6 (Benzamide,N-[2-(2-nitro-1H-imidazol-1-yl)ethyl]-)
36664-11-6 structure
Product Name:Benzamide,N-[2-(2-nitro-1H-imidazol-1-yl)ethyl]-
CAS No:36664-11-6
MF:C12H12N4O3
MW:260.248682022095
CID:323582
PubChem ID:328576
Update Time:2025-04-19
Benzamide,N-[2-(2-nitro-1H-imidazol-1-yl)ethyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,N-[2-(2-nitro-1H-imidazol-1-yl)ethyl]-
- N-[2-(2-nitroimidazol-1-yl)ethyl]benzamide
- AC1L72WN
- N-[2-(2-nitro-imidazol-1-yl)-ethyl]-benzamide
- N-< 2-(2-Nitro-1-imidazolyl)aethyl> benzamid
- NSC307259
- 36664-11-6
- NSC-307259
- DTXSID30316843
-
- Inchi: 1S/C12H12N4O3/c17-11(10-4-2-1-3-5-10)13-6-8-15-9-7-14-12(15)16(18)19/h1-5,7,9H,6,8H2,(H,13,17)
- InChI Key: LXQYHGSIHDYUPY-UHFFFAOYSA-N
- SMILES: O=C(C1C=CC=CC=1)NCCN1C=CN=C1[N+](=O)[O-]
Computed Properties
- Exact Mass: 260.09106
- Monoisotopic Mass: 260.091
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 325
- 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
- Topological Polar Surface Area: 92.7?2
- XLogP3: 1.2
Experimental Properties
- Density: 1.35
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.643
- PSA: 90.06
- LogP: 2.13540
Benzamide,N-[2-(2-nitro-1H-imidazol-1-yl)ethyl]- Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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