Cas no 13058-75-8 (3-nitro-1,5-Naphthyridine)
3-nitro-1,5-Naphthyridine structure
Product Name:3-nitro-1,5-Naphthyridine
CAS No:13058-75-8
MF:C8H5N3O2
MW:175.144201040268
CID:1104374
PubChem ID:13122790
Update Time:2025-04-20
3-nitro-1,5-Naphthyridine Chemical and Physical Properties
Names and Identifiers
-
- 3-nitro-1,5-Naphthyridine
- 1,5-Naphthyridine, 3-nitro-
- DTXSID10519638
- 13058-75-8
- SCHEMBL4515288
-
- Inchi: 1S/C8H5N3O2/c12-11(13)6-4-8-7(10-5-6)2-1-3-9-8/h1-5H
- InChI Key: CVLOAVGLAYWJHC-UHFFFAOYSA-N
- SMILES: [O-][N+](C1=CN=C2C=CC=NC2=C1)=O
Computed Properties
- Exact Mass: 349.08523
- Monoisotopic Mass: 175.038176411g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 204
- 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
- Topological Polar Surface Area: 71.6?2
Experimental Properties
- PSA: 68.92
3-nitro-1,5-Naphthyridine Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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