Cas no 647858-20-6 (Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]-)
![Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]- structure](https://ossimg.kuujia.com/scimg/648000/647858-20-6x500.png)
647858-20-6 structure
Product Name:Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]-
CAS No:647858-20-6
MF:C15H15NO4
MW:273.283904314041
CID:415850
PubChem ID:57165384
Update Time:2025-04-19
Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]-
- 1-nitro-4-(2-phenylmethoxyethoxy)benzene
- 4-(2-benzyloxyethoxy)-1-nitrobenzene
- 1-[2-(BENZYLOXY)ETHOXY]-4-NITROBENZENE
- SCHEMBL4758638
- DTXSID00720453
- 647858-20-6
-
- Inchi： 1S/C15H15NO4/c17-16(18)14-6-8-15(9-7-14)20-11-10-19-12-13-4-2-1-3-5-13/h1-9H,10-12H2
- InChI Key： YLAIHWFPOZEUIL-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)CCOC1C=CC(=CC=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 273.10015
- Monoisotopic Mass: 273.10010796g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 278
- 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: 3.1
- Topological Polar Surface Area: 64.3?2
Experimental Properties
- PSA: 61.6
Benzene, 1-nitro-4-[2-(phenylmethoxy)ethoxy]- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Masrudin Md Yusoff,Muggundha Raoov,Noorfatimah Yahaya,Noorashikin Md Salleh RSC Adv., 2017,7, 35832-35844
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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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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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