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CAS 717-01-1

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Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester

Description:
Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester, commonly referred to as ethyl 3-hydroxy-4-nitrobenzoate, is an organic compound characterized by its ester functional group derived from benzoic acid. It features a nitro group and a hydroxyl group on the benzene ring, contributing to its chemical reactivity and potential applications. The presence of these functional groups can influence its solubility, stability, and interaction with other chemicals. Typically, this compound appears as a solid or liquid, depending on the temperature and purity. It is often used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals, agrochemicals, or dyes. The compound's properties, such as melting point, boiling point, and solubility, can vary based on the specific conditions and purity. Safety data indicates that it should be handled with care, as it may pose health risks if ingested or inhaled. Proper storage and handling protocols are essential to ensure safety in laboratory and industrial settings.
Formula:C9H9NO5
InChI:InChI=1S/C9H9NO5/c1-2-15-9(12)6-3-4-7(10(13)14)8(11)5-6/h3-5,11H,2H2,1H3
InChI key:InChIKey=VDARTPBFQUTSTO-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=CC(O)=C(N(=O)=O)C=C1
Synonyms:
  • 3-Hydroxy-4-nitrobenzoic acid ethyl ester
  • Ethyl 3-hydroxy-4-nitrobenzoate
  • Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester
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