CAS 101084-61-1

3-Methyl-6-nitro-2(3H)-benzoxazolone

Description:

3-Methyl-6-nitro-2(3H)-benzoxazolone is an organic compound characterized by its heterocyclic structure, which includes a benzoxazolone ring with a methyl group and a nitro group substituent. This compound typically exhibits a yellow to orange color, indicative of its nitro group, which can also influence its reactivity and solubility. It is generally soluble in organic solvents, such as ethanol and acetone, but may have limited solubility in water due to its hydrophobic characteristics. The presence of the nitro group contributes to its potential as a chromophore, making it useful in various applications, including dyes and pigments. Additionally, the compound may exhibit biological activity, which can be explored in pharmaceutical research. Its stability under standard conditions is typical for similar heterocyclic compounds, although it may be sensitive to strong reducing agents. Safety precautions should be taken when handling this substance, as nitro compounds can be hazardous. Overall, 3-Methyl-6-nitro-2(3H)-benzoxazolone is a versatile compound with potential applications in both industrial and research settings.

Formula: C₈H₆N₂O₄

InChI: InChI=1S/C8H6N2O4/c1-9-6-3-2-5(10(12)13)4-7(6)14-8(9)11/h2-4H,1H3

InChI key: InChIKey=VUKIKMHYSUVLQB-UHFFFAOYSA-N

SMILES: CN1C=2C(=CC(N(=O)=O)=CC2)OC1=O

Synonyms:

• 2(3H)-Benzoxazolone, 3-methyl-6-nitro-
• 3-Methyl-6-nitro-2(3H)-benzoxazolone
• 3-Methyl-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one
• 6-Nitro-3-methyl-3H-benzoxazol-2-one
• 2-Benzoxazolinone, 3-methyl-6-nitro-