Cas no 73455-94-4 (1-methyl-4-nitro-1H-Imidazole-2-carboxaldehyde)
73455-94-4 structure
Product Name:1-methyl-4-nitro-1H-Imidazole-2-carboxaldehyde
CAS No:73455-94-4
MF:C5H5N3O3
MW:155.111500501633
CID:552325
PubChem ID:14111310
Update Time:2025-04-19
1-methyl-4-nitro-1H-Imidazole-2-carboxaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 1-methyl-4-nitro-1H-Imidazole-2-carboxaldehyde
- 1H-Imidazole-2-carboxaldehyde, 1-methyl-4-nitro- (9CI)
- 1H-Imidazole-2-carboxaldehyde,1-methyl-4-nitro-
- 1-methyl-4-nitroimidazole-2-carbaldehyde
- 1-Methyl-4-nitroimidazole-2-carboxaldehyde
- 1-Methyl-4-nitro-1H-imidazole-2-carbaldehyde
- DTXSID00555989
- 73455-94-4
- 2-formyl-1-methyl-4-nitroimidazole
- VKNJBTMMRCVSOH-UHFFFAOYSA-N
- 2-formyl-1-methyl-4nitroimidazole
- SCHEMBL5331712
-
- Inchi： 1S/C5H5N3O3/c1-7-2-4(8(10)11)6-5(7)3-9/h2-3H,1H3
- InChI Key： VKNJBTMMRCVSOH-UHFFFAOYSA-N
- SMILES： O=CC1=NC(=CN1C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 155.03309103g/mol
- Monoisotopic Mass: 155.03309103g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 178
- 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: -0.9
- Topological Polar Surface Area: 80.7?2
1-methyl-4-nitro-1H-Imidazole-2-carboxaldehyde Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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