Cas no 46401-48-3 (4-Methyl-3,5-dinitrobenzaldehyde)
46401-48-3 structure
Product Name:4-Methyl-3,5-dinitrobenzaldehyde
CAS No:46401-48-3
MF:C8H6N2O5
MW:210.1436419487
CID:325531
PubChem ID:53404364
Update Time:2025-04-19
4-Methyl-3,5-dinitrobenzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 4-Methyl-3,5-dinitrobenzaldehyde
- Benzaldehyde,4-methyl-3,5-dinitro-
- 46401-48-3
- DTXSID80695372
- AKOS022173617
- SCHEMBL14035450
-
- MDL： MFCD08703357
- Inchi： 1S/C8H6N2O5/c1-5-7(9(12)13)2-6(4-11)3-8(5)10(14)15/h2-4H,1H3
- InChI Key： ATRPDICPDXLRLL-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=O)C=C(C=1C)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 210.028
- Monoisotopic Mass: 210.028
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 258
- 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: 1.2
- Topological Polar Surface Area: 109?2
4-Methyl-3,5-dinitrobenzaldehyde Related Literature
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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3. 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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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
46401-48-3 (4-Methyl-3,5-dinitrobenzaldehyde) Related Products
- 528-75-6(2,4-Dinitrobenzaldehyde)
- 18515-67-8(3-Methyl-4-nitrobenzaldehyde)
- 5858-28-6(5-Methyl-2-nitrobenzaldehyde)
- 69022-52-2(2,5-Dimethyl-3-nitrobenzaldehyde)
- 31680-07-6(4-Methyl-3-nitrobenzaldehyde)
- 552-89-6(2-Nitrobenzaldehyde)
- 606-31-5(2,6-Dinitrobenzaldehyde)
- 23876-12-2(2-Methyl-3-nitrobenzaldehyde)
- 20357-22-6(4-Methyl-2-nitrobenzaldehyde)
- 56008-61-8(2-amino-5-nitrobenzaldehyde)
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