Cas no 648891-34-3 (Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis-)
![Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis- structure](https://ossimg.kuujia.com/scimg/649000/648891-34-3x500.png)
648891-34-3 structure
Product Name:Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis-
CAS No:648891-34-3
MF:C20H11N3O5
MW:373.318444490433
CID:413466
PubChem ID:71378184
Update Time:2025-04-19
Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis-
- 4-[3-(4-cyanophenoxy)-5-hydroxy-4-nitrophenoxy]benzonitrile
- 648891-34-3
- 4,4'-[(5-Hydroxy-4-nitro-1,3-phenylene)bis(oxy)]dibenzonitrile
- DTXSID60800806
-
- Inchi： 1S/C20H11N3O5/c21-11-13-1-5-15(6-2-13)27-17-9-18(24)20(23(25)26)19(10-17)28-16-7-3-14(12-22)4-8-16/h1-10,24H
- InChI Key： HMUSXSWFJHVMMD-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C#N)=CC=1)C1C=C(C=C(C=1[N+](=O)[O-])O)OC1C=CC(C#N)=CC=1
Computed Properties
- Exact Mass: 373.06993
- Monoisotopic Mass: 373.06987046g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 28
- Rotatable Bond Count: 4
- Complexity: 631
- 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: 4.4
- Topological Polar Surface Area: 132?2
Experimental Properties
- PSA: 129.41
Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis- Related Literature
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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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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
648891-34-3 (Benzonitrile, 4,4'-[(5-hydroxy-4-nitro-1,3-phenylene)bis(oxy)]bis-) Related Products
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