CAS 618-98-4

Benzoic acid, 3-nitro-, ethyl ester

Description:

Benzoic acid, 3-nitro-, ethyl ester, also known as ethyl 3-nitrobenzoate, is an organic compound characterized by its ester functional group derived from benzoic acid and ethanol. It features a nitro group (-NO2) positioned at the meta position relative to the carboxylic acid group on the benzene ring. This compound typically appears as a colorless to pale yellow liquid with a sweet, fruity odor. It is moderately soluble in water but more soluble in organic solvents such as ethanol and ether. Ethyl 3-nitrobenzoate is primarily used in organic synthesis, serving as an intermediate in the production of various pharmaceuticals, agrochemicals, and dyes. Its reactivity is influenced by the electron-withdrawing nature of the nitro group, which can affect the compound's electrophilic substitution reactions. Safety data indicates that it should be handled with care, as it may cause irritation to the skin and eyes. Proper storage in a cool, dry place away from incompatible substances is recommended to maintain its stability.

Formula: C₉H₉NO₄

InChI: InChI=1S/C9H9NO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6H,2H2,1H3

InChI key: InChIKey=MKBIJCPQTPFQKQ-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C1=CC(N(=O)=O)=CC=C1

Synonyms:

• 3-Nitrobenzoic acid ethyl ester
• Benzoic acid, 3-nitro-, ethyl ester
• Benzoic acid, m-nitro-, ethyl ester
• Ethyl m-nitrobenzoate
• NSC 32740
• NSC 6762
• ethyl 3-nitrobenzoate/3-Nitrobenzoic acid ethyl ester
• Ethyl 3-nitrobenzoate

Ethyl 3-nitrobenzoate, 98+%

CAS: 618-98-4

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₉H₉NO₄

Purity: 98+%

Color and Shape: White to pale yellow, Crystals or powder or crystalline powder

Molecular weight: 195.17

Ref: 02-A10626

Ethyl 3-nitrobenzoate

CAS: 618-98-4

Formula: C₉H₉NO₄

Purity: 95%

Color and Shape: Solid

Molecular weight: 195.1721

Ref: IN-DA003Q8A

Ethyl 3-nitrobenzoate

CAS: 618-98-4

Ethyl 3-nitrobenzoate

Purity: 98%

Molecular weight: 195.17206g/mol

Ref: 54-OR21789

Ethyl 3-nitrobenzoate

CAS: 618-98-4

Ethyl 3-nitrobenzoate is an organic compound that belongs to the methyl ketones group. It is a colorless liquid with a sweet, aromatic odor. Ethyl 3-nitrobenzoate has been shown to interact with benzocaine and other local anesthetics, which may lead to its use as a precursor for these drugs. It can also be used as a carbon source for bacterial cells and can be used in an efficient method for the synthesis of antigenic determinants. This compound has been shown to have anticomplementary properties and may be useful in treatment of bacterial infections.

Formula: C₉H₉NO₄

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 195.17 g/mol

Ref: 3D-FE71149

Ethyl 3-nitrobenzoate

CAS: 618-98-4

Formula: C₉H₉NO₄

Purity: 98%

Color and Shape: Solid

Molecular weight: 195.174

Ref: 10-F018688