Cas no 54291-78-0 (Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro-)
54291-78-0 structure
Product Name:Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro-
CAS No:54291-78-0
MF:C14H11NO5
MW:273.240844011307
CID:354975
PubChem ID:487818
Update Time:2025-04-19
Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro-
- 4-(2-methoxyphenoxy)-3-nitrobenzaldehyde
- AKOS005201413
- DTXSID40333167
- 54291-78-0
- 4-(2-methoxyphenoxy)-3-nitro-benzaldehyde
- 4-(2-Methoxy-phenoxy)-3-nitro-benzaldehyde
-
- Inchi： 1S/C14H11NO5/c1-19-13-4-2-3-5-14(13)20-12-7-6-10(9-16)8-11(12)15(17)18/h2-9H,1H3
- InChI Key： FCCMBBCBTYCOGW-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1OC)C1C=CC(C=O)=CC=1[N+](=O)[O-]
Computed Properties
- Exact Mass: 273.06373
- Monoisotopic Mass: 273.064
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 343
- 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: 2.7
- Topological Polar Surface Area: 81.4?2
Experimental Properties
- PSA: 78.67
Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro- Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
54291-78-0 (Benzaldehyde, 4-(2-methoxyphenoxy)-3-nitro-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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