Cas no 89563-22-4 (Benzene, 1-iodo-3,5-dinitro-2-phenoxy-)
89563-22-4 structure
Product Name:Benzene, 1-iodo-3,5-dinitro-2-phenoxy-
CAS No:89563-22-4
MF:C12H7IN2O5
MW:386.098855257034
CID:596529
PubChem ID:1820001
Update Time:2025-04-19
Benzene, 1-iodo-3,5-dinitro-2-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-iodo-3,5-dinitro-2-phenoxy-
- 1-iodo-3,5-dinitro-2-phenoxybenzene
- 89563-22-4
- DTXSID80365306
- AP-915/40882328
-
- Inchi: 1S/C12H7IN2O5/c13-10-6-8(14(16)17)7-11(15(18)19)12(10)20-9-4-2-1-3-5-9/h1-7H
- InChI Key: VDTKZNVXBILUPJ-UHFFFAOYSA-N
- SMILES: IC1=CC(=CC(=C1OC1C=CC=CC=1)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 385.93997g/mol
- Monoisotopic Mass: 385.93997g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 364
- 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: 3.8
- Topological Polar Surface Area: 101?2
Benzene, 1-iodo-3,5-dinitro-2-phenoxy- Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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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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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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