Cas no 79568-05-1 (Methanone, (3-nitrophenyl)-3-pyridinyl-)
79568-05-1 structure
Product Name:Methanone, (3-nitrophenyl)-3-pyridinyl-
CAS No:79568-05-1
MF:C12H8N2O3
MW:228.20352268219
CID:1800543
PubChem ID:12930027
Update Time:2025-04-21
Methanone, (3-nitrophenyl)-3-pyridinyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (3-nitrophenyl)-3-pyridinyl-
- KAMRUHHCLSYNFU-UHFFFAOYSA-N
- 3-(3-Nitrobenzoyl)pyridine
- SCHEMBL6833376
- (3-Nitrophenyl)(pyridin-3-yl)methanone
- 79568-05-1
-
- MDL： MFCD13152914
- Inchi： 1S/C12H8N2O3/c15-12(10-4-2-6-13-8-10)9-3-1-5-11(7-9)14(16)17/h1-8H
- InChI Key： KAMRUHHCLSYNFU-UHFFFAOYSA-N
- SMILES： O=C(C1C=NC=CC=1)C1C=CC=C(C=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 228.05349212g/mol
- Monoisotopic Mass: 228.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 301
- 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: 1.7
- Topological Polar Surface Area: 75.8?2
Methanone, (3-nitrophenyl)-3-pyridinyl- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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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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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
79568-05-1 (Methanone, (3-nitrophenyl)-3-pyridinyl-) Related Products
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