4'-Nitroacetophenone
Names and Identifiers of 4'-Nitroacetophenone
CAS Number |
100-19-6 |
|---|---|
EC Number |
202-827-4 |
MDL Number |
MFCD00007355 |
IUPAC Name |
1-(4-nitrophenyl)ethanone |
InChI |
InChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3 |
InChIKey |
YQYGPGKTNQNXMH-UHFFFAOYSA-N |
Canonical SMILES |
CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
UNII |
4FM2J8HQ27 |
UNSPSC Code |
12352100 |
Physical and chemical properties of 4'-Nitroacetophenone
Boiling Point |
396 °F at 760 mmHg (NTP, 1992) |
|---|---|
BRN |
607777 |
Density |
1.2±0.1 g/cm3 |
Exact Mass |
165.042587 |
Flash Point |
129.4±12.6 °C |
Index of Refraction |
1.558 |
LogP |
1.42 |
Melting Point |
176 to 180 °F (NTP, 1992) |
Molecular Formula |
C8H7NO3 |
Molecular Weight |
165.146 |
PSA |
62.89000 |
Storage condition |
Sealed in dry,Room Temperature |
Vapour Pressure |
0.0024 [mmHg] |
Water Solubility |
Insoluble in water. |
Safety Information of 4'-Nitroacetophenone
Applications of 4'-Nitroacetophenone
4'-Nitroacetophenone serves multiple roles in various fields:
- Pharmaceuticals: It is used as an intermediate in the synthesis of important drugs such as chloramphenicol and bronchodilators like clenbuterol.
- Organic synthesis: The compound is utilized as a reagent for synthesizing other organic compounds, including thiosemicarbazones and oxiranes.
- Research: Its derivatives are studied for their potential biological activities, making them relevant in medicinal chemistry.
Interaction Studies of 4'-Nitroacetophenone
Studies on 4'-nitroacetophenone interactions primarily focus on its reactivity with other chemical agents. For example, it has been noted that the compound reacts violently with strong oxidizers such as nitric acid and peracids, which can lead to hazardous situations if not handled properly.
Furthermore, research into its biological interactions suggests that its derivatives may interact with biological targets relevant to treating parasitic infections.
Biological Activity of 4'-Nitroacetophenone
Research indicates that 4'-nitroacetophenone exhibits biological activity, particularly in relation to its derivatives. For instance, certain derivatives of 4'-nitroacetophenone have shown potential anti-trypanosomal activity in vitro. This suggests that compounds derived from 4'-nitroacetophenone could be explored for therapeutic applications against diseases caused by Trypanosoma parasites.
Physical sample testing spectrum (NMR) of 4'-Nitroacetophenone
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