CAS 1951440-96-2
:1,1-Dimethylethyl 4-(1,1-dimethylethoxy)-3-nitrobenzoate
Description:
1,1-Dimethylethyl 4-(1,1-dimethylethoxy)-3-nitrobenzoate, identified by its CAS number 1951440-96-2, is an organic compound characterized by its ester functional group, which is formed from the reaction of a carboxylic acid and an alcohol. This compound features a nitro group, which is a strong electron-withdrawing group, attached to a benzene ring, influencing its reactivity and properties. The presence of the tert-butyl (1,1-dimethylethyl) and 1,1-dimethylethoxy groups contributes to its steric bulk, potentially affecting its solubility and interaction with other molecules. Generally, compounds with such structures may exhibit interesting biological activities, making them of interest in medicinal chemistry and materials science. The specific characteristics, such as melting point, boiling point, and solubility, would depend on the molecular interactions and the overall structure of the compound. As with many organic compounds, safety data and handling precautions should be considered, particularly due to the presence of the nitro group, which can impart explosive properties under certain conditions.
Formula:C15H21NO5
InChI:InChI=1S/C15H21NO5/c1-14(2,3)20-12-8-7-10(9-11(12)16(18)19)13(17)21-15(4,5)6/h7-9H,1-6H3
InChI key:InChIKey=ZEMPJOPTZVBAET-UHFFFAOYSA-N
SMILES:O(C(C)(C)C)C1=C(N(=O)=O)C=C(C(OC(C)(C)C)=O)C=C1
Synonyms:- 1,1-Dimethylethyl 4-(1,1-dimethylethoxy)-3-nitrobenzoate
- Benzoic acid, 4-(1,1-dimethylethoxy)-3-nitro-, 1,1-dimethylethyl ester
Sort by
Purity (%)
0
100
|
0
|
50
|
90
|
95
|
100
Found 1 products.
