Cas no 72848-48-7 (Phenazine, 2,7-dinitro-)
Phenazine, 2,7-dinitro- structure
Product Name:Phenazine, 2,7-dinitro-
CAS No:72848-48-7
MF:C12H6N4O4
MW:270.200441837311
CID:572460
PubChem ID:135528
Update Time:2025-04-19
Phenazine, 2,7-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Phenazine, 2,7-dinitro-
- 2,7-dinitrophenazine
- BRN 0819258
- 5826ED6CWQ
- AKOS002346533
- DTXSID20223158
- CCRIS 3019
- 72848-48-7
-
- Inchi： 1S/C12H6N4O4/c17-15(18)7-1-3-9-11(5-7)14-10-4-2-8(16(19)20)6-12(10)13-9/h1-6H
- InChI Key： DJPIQROJAVSPDY-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2C(C=1)=NC1C=CC(=CC=1N=2)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 270.03898
- Monoisotopic Mass: 270.03890469g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 369
- 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: 2.3
- Topological Polar Surface Area: 117?2
Experimental Properties
- PSA: 112.06
Phenazine, 2,7-dinitro- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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