Cas no 88356-11-0 (Benzene, 1-(diethoxymethyl)-2-nitro-)
88356-11-0 structure
Product Name:Benzene, 1-(diethoxymethyl)-2-nitro-
CAS No:88356-11-0
MF:C11H15NO4
MW:225.241103410721
CID:635601
PubChem ID:11401857
Update Time:2025-04-19
Benzene, 1-(diethoxymethyl)-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-(diethoxymethyl)-2-nitro-
- 1-(diethoxymethyl)-2-nitrobenzene
- DTXSID10464755
- SCHEMBL10478039
- o-Nitrobenzaldehyd-diathylacetal
- 88356-11-0
-
- Inchi： 1S/C11H15NO4/c1-3-15-11(16-4-2)9-7-5-6-8-10(9)12(13)14/h5-8,11H,3-4H2,1-2H3
- InChI Key： GXYWWDNGNXXZLR-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C=CC=CC=1[N+](=O)[O-])OCC
Computed Properties
- Exact Mass: 225.10010796g/mol
- Monoisotopic Mass: 225.10010796g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 211
- 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: 2.1
- Topological Polar Surface Area: 64.3?2
Benzene, 1-(diethoxymethyl)-2-nitro- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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